2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide

C13H10N6O2 — CID 103763580

IUPAC2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide
SMILESO=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc[nH]c(=O)c1
InChIInChI=1S/C13H10N6O2/c20-11-7-9(4-5-14-11)13(21)15-10-3-1-2-8(6-10)12-16-18-19-17-12/h1-7H,(H,14,20)(H,15,21)(H,16,17,18,19)
InChIKeyCZGBPPDPSPMEMC-UHFFFAOYSA-N
MW282.26 g/mol
LogP0.81
Rot. Bonds3

About 2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide

2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide (PubChem CID 103763580) has the molecular formula C13H10N6O2 and a molecular weight of 282.26 g/mol. Its IUPAC name is 2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide
PubChem CID103763580
Molecular FormulaC13H10N6O2
Molecular Weight282.26 g/mol
Exact Mass282.09
IUPAC Name2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide
SMILESO=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc[nH]c(=O)c1
InChIInChI=1S/C13H10N6O2/c20-11-7-9(4-5-14-11)13(21)15-10-3-1-2-8(6-10)12-16-18-19-17-12/h1-7H,(H,14,20)(H,15,21)(H,16,17,18,19)
InChIKeyCZGBPPDPSPMEMC-UHFFFAOYSA-N
XLogP0.81
TPSA116.42 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.26
LogP ≤ 50.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-bromo-N-[3-(2H-tetrazol-5-yl)phenyl]benzamide
CID 17126994
3,4-dichloro-N-[3-(2H-tetrazol-5-yl)phenyl]benzamide
CID 17163668
3-nitro-N-[3-(2H-tetrazol-5-yl)phenyl]benzamide
CID 17163937
N-[3-(2H-tetrazol-5-yl)phenyl]-4-(trifluoromethyl)benzamide
CID 9404095
N-[3-(2H-tetrazol-5-yl)phenyl]-1H-indazole-5-carboxamide
CID 56851706
2-(2,6-dichlorophenyl)-N-[3-(2H-tetrazol-5-yl)phenyl]-3H-benzimidazole-5-carboxamide
CID 25064923
2,3-dimethoxy-N-[3-(2H-tetrazol-5-yl)phenyl]benzamide
CID 17164751
2-chloro-6-fluoro-N-[3-(2H-tetrazol-5-yl)phenyl]benzamide
CID 17165094
3-[(pyrimidin-4-ylamino)methyl]-N-[3-(2H-tetrazol-5-yl)phenyl]benzamide
CID 166211148
ethyl N-[3-(2H-tetrazol-5-yl)phenyl]carbamate
CID 17164270
3-amino-2-methyl-N-[3-(2H-tetrazol-5-yl)phenyl]propanamide
CID 55104793
2-(methylamino)-N-[3-(2H-tetrazol-5-yl)phenyl]propanamide
CID 62639485

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide?
The IUPAC name of 2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide (CID 103763580) is 2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide is O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc[nH]c(=O)c1.
What is the InChIKey of 2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide?
The InChIKey is CZGBPPDPSPMEMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N6O2/c20-11-7-9(4-5-14-11)13(21)15-10-3-1-2-8(6-10)12-16-18-19-17-12/h1-7H,(H,14,20)(H,15,21)(H,16,17,18,19).
What are the key properties of 2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide?
2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide has a molecular weight of 282.26 g/mol, XLogP of 0.81, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-[3-(2H-tetrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide is sourced from PubChem (CID 103763580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).