Home Other Building Blocks 2-(1,4-diazepan-1-yl)-N-(prop-2-yn-1-yl)acetamide dihydrochloride

2-(1,4-diazepan-1-yl)-N-(prop-2-yn-1-yl)acetamide dihydrochloride

CAS No.:
1258650-82-6
Catalog Number:
AG01AB2E
Molecular Formula:
C10H19Cl2N3O
Molecular Weight:
268.1834
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Product Description
Catalog Number:
AG01AB2E
Chemical Name:
2-(1,4-diazepan-1-yl)-N-(prop-2-yn-1-yl)acetamide dihydrochloride
CAS Number:
1258650-82-6
Molecular Formula:
C10H19Cl2N3O
Molecular Weight:
268.1834
MDL Number:
MFCD17977041
IUPAC Name:
2-(1,4-diazepan-1-yl)-N-prop-2-ynylacetamide;dihydrochloride
InChI:
InChI=1S/C10H17N3O.2ClH/c1-2-4-12-10(14)9-13-7-3-5-11-6-8-13;;/h1,11H,3-9H2,(H,12,14);2*1H
InChI Key:
NXLIKMLXYQXPGP-UHFFFAOYSA-N
SMILES:
C#CCNC(=O)CN1CCNCCC1.Cl.Cl
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.091g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
268.182g/mol
Monoisotopic Mass:
267.091g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties