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

C11H14N6O — CID 13209560

IUPAC4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
SMILESCCCCc1ccnc(C(=O)Nc2nn[nH]n2)c1
InChIInChI=1S/C11H14N6O/c1-2-3-4-8-5-6-12-9(7-8)10(18)13-11-14-16-17-15-11/h5-7H,2-4H2,1H3,(H2,13,14,15,16,17,18)
InChIKeyYAWLONSQRGPSEX-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.19
Rot. Bonds5

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

4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide (PubChem CID 13209560) has the molecular formula C11H14N6O and a molecular weight of 246.27 g/mol. Its IUPAC name is 4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
PubChem CID13209560
Molecular FormulaC11H14N6O
Molecular Weight246.27 g/mol
Exact Mass246.12
IUPAC Name4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
SMILESCCCCc1ccnc(C(=O)Nc2nn[nH]n2)c1
InChIInChI=1S/C11H14N6O/c1-2-3-4-8-5-6-12-9(7-8)10(18)13-11-14-16-17-15-11/h5-7H,2-4H2,1H3,(H2,13,14,15,16,17,18)
InChIKeyYAWLONSQRGPSEX-UHFFFAOYSA-N
XLogP1.19
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide
CID 86992066
(5-Amino-3-pyridin-2-yl-1,2,4-triazol-1-yl)-(4-ethylphenyl)methanone
CID 162651731
(5-Amino-3-pyridin-2-yl-1,2,4-triazol-1-yl)-(4-fluorophenyl)methanone
CID 162654445
(5-Amino-3-pyridin-2-yl-1,2,4-triazol-1-yl)-(3-methylphenyl)methanone
CID 162664502
N-(5-oxo-7-phenyl-3,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)pyridine-2-carboxamide
CID 664224
N-(1,3,4-thiadiazol-2-yl)picolinamide
CID 1204532
1-Methyl-4-pyridin-4-ylpyrrole-2-carboxamide
CID 86274747
TA-5707
CID 23711636
N-hydroxy-4-(2H-tetrazol-5-yl)pyridine-2-carboxamide
CID 135567437
3,6-dimethyl-N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)pyridine-2-carboxamide
CID 165415191
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

Frequently Asked Questions

What is the IUPAC name of 4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The IUPAC name of 4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide (CID 13209560) is 4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide.
What is the SMILES notation for 4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The canonical SMILES for 4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide is CCCCc1ccnc(C(=O)Nc2nn[nH]n2)c1.
What is the InChIKey of 4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The InChIKey is YAWLONSQRGPSEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O/c1-2-3-4-8-5-6-12-9(7-8)10(18)13-11-14-16-17-15-11/h5-7H,2-4H2,1H3,(H2,13,14,15,16,17,18).
What are the key properties of 4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 1.19, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide is sourced from PubChem (CID 13209560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).