Name: Name:3-(5-phenyl-1H-1,2,4-triazol-3-yl)piperidine
Brand: Angene
SKU: AG01A5BR
Rating: 90 (10 reviews)

3-(5-phenyl-1H-1,2,4-triazol-3-yl)piperidine

CAS No.:

933684-80-1

Catalog Number:

AG01A5BR

Molecular Formula:

C13H16N4

Molecular Weight:

228.2929

Catalog Number:

AG01A5BR

Chemical Name:

3-(5-phenyl-1H-1,2,4-triazol-3-yl)piperidine

CAS Number:

933684-80-1

Molecular Formula:

C13H16N4

Molecular Weight:

228.2929

MDL Number:

MFCD13452496

IUPAC Name:

3-(3-phenyl-1H-1,2,4-triazol-5-yl)piperidine

InChI:

InChI=1S/C13H16N4/c1-2-5-10(6-3-1)12-15-13(17-16-12)11-7-4-8-14-9-11/h1-3,5-6,11,14H,4,7-9H2,(H,15,16,17)

InChI Key:

YZRMJEUPVCOVSO-UHFFFAOYSA-N

SMILES:

C1CCC(CN1)c1n[nH]c(n1)c1ccccc1

Complexity:

240

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

228.137g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

228.299g/mol

Monoisotopic Mass:

228.137g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

53.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8