Name: Name:2-(4-methyl-1,4-diazepane-1-carbonyl)aniline
Brand: Angene
SKU: AG01A88P
Rating: 90 (10 reviews)

2-(4-methyl-1,4-diazepane-1-carbonyl)aniline

CAS No.:

1042522-74-6

Catalog Number:

AG01A88P

Molecular Formula:

C13H19N3O

Molecular Weight:

233.3095

Catalog Number:

AG01A88P

Chemical Name:

2-(4-methyl-1,4-diazepane-1-carbonyl)aniline

CAS Number:

1042522-74-6

Molecular Formula:

C13H19N3O

Molecular Weight:

233.3095

MDL Number:

MFCD11168541

IUPAC Name:

(2-aminophenyl)-(4-methyl-1,4-diazepan-1-yl)methanone

InChI:

InChI=1S/C13H19N3O/c1-15-7-4-8-16(10-9-15)13(17)11-5-2-3-6-12(11)14/h2-3,5-6H,4,7-10,14H2,1H3

InChI Key:

CGJHNBMXCIQQMX-UHFFFAOYSA-N

SMILES:

CN1CCCN(CC1)C(=O)c1ccccc1N

Complexity:

269

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.153g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.315g/mol

Monoisotopic Mass:

233.153g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4