3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide

C15H14N6O — CID 47016922

IUPAC3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide
SMILESO=C(Nc1cccnc1)C(Cc1ccccc1)n1cnnn1
InChIInChI=1S/C15H14N6O/c22-15(18-13-7-4-8-16-10-13)14(21-11-17-19-20-21)9-12-5-2-1-3-6-12/h1-8,10-11,14H,9H2,(H,18,22)
InChIKeyUVPUXUSRTPDLNO-UHFFFAOYSA-N
MW294.32 g/mol
LogP1.49
Rot. Bonds5

About 3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide

3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide (PubChem CID 47016922) has the molecular formula C15H14N6O and a molecular weight of 294.32 g/mol. Its IUPAC name is 3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide.

Molecular Properties

Compound Name3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide
PubChem CID47016922
Molecular FormulaC15H14N6O
Molecular Weight294.32 g/mol
Exact Mass294.12
IUPAC Name3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide
SMILESO=C(Nc1cccnc1)C(Cc1ccccc1)n1cnnn1
InChIInChI=1S/C15H14N6O/c22-15(18-13-7-4-8-16-10-13)14(21-11-17-19-20-21)9-12-5-2-1-3-6-12/h1-8,10-11,14H,9H2,(H,18,22)
InChIKeyUVPUXUSRTPDLNO-UHFFFAOYSA-N
XLogP1.49
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.32
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-methyl-4-pyridin-3-yloxyphenyl)-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 60581011
3-phenyl-N-[3-(pyrazol-1-ylmethyl)phenyl]-2-(tetrazol-1-yl)propanamide
CID 55610798
3-phenyl-N-[4-(sulfamoylmethyl)phenyl]-2-(tetrazol-1-yl)propanamide
CID 24669149
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 51229017
(2R)-N-benzhydryl-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 41096542
(2R)-2-[(1R,2R,6S,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]-3-phenyl-N-pyridin-3-ylpropanamide
CID 98158707
(2R)-3-phenyl-N-prop-2-ynyl-2-(tetrazol-1-yl)propanamide
CID 94393857
propyl 4-[[3-phenyl-2-(tetrazol-1-yl)propanoyl]amino]benzoate
CID 74661614
N-(2,4-difluorophenyl)-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 51229552
(2S)-N-(2-ethoxyphenyl)-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 51981117
N-(2-fluoro-4-hydroxyphenyl)-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 86798495
(2S)-N-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-3-phenyl-2-(tetrazol-1-yl)propanamide
CID 75488929

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide?
The IUPAC name of 3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide (CID 47016922) is 3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide.
What is the SMILES notation for 3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide?
The canonical SMILES for 3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide is O=C(Nc1cccnc1)C(Cc1ccccc1)n1cnnn1.
What is the InChIKey of 3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide?
The InChIKey is UVPUXUSRTPDLNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N6O/c22-15(18-13-7-4-8-16-10-13)14(21-11-17-19-20-21)9-12-5-2-1-3-6-12/h1-8,10-11,14H,9H2,(H,18,22).
What are the key properties of 3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide?
3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide has a molecular weight of 294.32 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-pyridin-3-yl-2-(tetrazol-1-yl)propanamide is sourced from PubChem (CID 47016922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).