4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide

C10H12N6O — CID 13209557

IUPAC4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
SMILESCC(C)c1ccnc(C(=O)Nc2nn[nH]n2)c1
InChIInChI=1S/C10H12N6O/c1-6(2)7-3-4-11-8(5-7)9(17)12-10-13-15-16-14-10/h3-6H,1-2H3,(H2,12,13,14,15,16,17)
InChIKeyUSPHMRYJSNQQRF-UHFFFAOYSA-N
MW232.25 g/mol
LogP0.97
Rot. Bonds3

About 4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide

4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide (PubChem CID 13209557) has the molecular formula C10H12N6O and a molecular weight of 232.25 g/mol. Its IUPAC name is 4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
PubChem CID13209557
Molecular FormulaC10H12N6O
Molecular Weight232.25 g/mol
Exact Mass232.11
IUPAC Name4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
SMILESCC(C)c1ccnc(C(=O)Nc2nn[nH]n2)c1
InChIInChI=1S/C10H12N6O/c1-6(2)7-3-4-11-8(5-7)9(17)12-10-13-15-16-14-10/h3-6H,1-2H3,(H2,12,13,14,15,16,17)
InChIKeyUSPHMRYJSNQQRF-UHFFFAOYSA-N
XLogP0.97
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide
CID 86992066
N-(1,3,4-thiadiazol-2-yl)picolinamide
CID 1204532
N-hydroxy-4-(2H-tetrazol-5-yl)pyridine-2-carboxamide
CID 135567437
N-(1H-Tetrazol-5-yl)-4-methyl-6-(4-(methylamino)phenyl)-2-pyridinecarboxamide
CID 133334
6-methyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
CID 3068264
N-(2H-tetrazol-5-yl)pyridine-4-carboxamide
CID 3466840
N-(2H-tetrazol-5-yl)pyridine-3-carboxamide
CID 4069765
6-phenyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
CID 12784899
N-(5-tetrazolyl)-4-methyl-6-(4-dimethylaminophenyl)-2-pyridinecarboxamide
CID 12811070
N-(5-tetrazolyl)-4-methyl-6-(4-diethylaminophenyl)-2-pyridinecarboxamide
CID 12811072
6-[4-(methylamino)phenyl]-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
CID 12811080
6-(4-aminophenyl)-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
CID 12811089

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The IUPAC name of 4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide (CID 13209557) is 4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide.
What is the SMILES notation for 4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The canonical SMILES for 4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide is CC(C)c1ccnc(C(=O)Nc2nn[nH]n2)c1.
What is the InChIKey of 4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The InChIKey is USPHMRYJSNQQRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O/c1-6(2)7-3-4-11-8(5-7)9(17)12-10-13-15-16-14-10/h3-6H,1-2H3,(H2,12,13,14,15,16,17).
What are the key properties of 4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide has a molecular weight of 232.25 g/mol, XLogP of 0.97, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide is sourced from PubChem (CID 13209557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).