6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide

C15H16N6O — CID 166311917

IUPAC6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide
SMILESC#CCC1(NC(=O)c2ccc(-c3nn[nH]n3)c(C)n2)CCC1
InChIInChI=1S/C15H16N6O/c1-3-7-15(8-4-9-15)17-14(22)12-6-5-11(10(2)16-12)13-18-20-21-19-13/h1,5-6H,4,7-9H2,2H3,(H,17,22)(H,18,19,20,21)
InChIKeyZQWBIEJSQCNGRX-UHFFFAOYSA-N
MW296.33 g/mol
LogP1.25
Rot. Bonds4

About 6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide

6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide (PubChem CID 166311917) has the molecular formula C15H16N6O and a molecular weight of 296.33 g/mol. Its IUPAC name is 6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide
PubChem CID166311917
Molecular FormulaC15H16N6O
Molecular Weight296.33 g/mol
Exact Mass296.14
IUPAC Name6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide
SMILESC#CCC1(NC(=O)c2ccc(-c3nn[nH]n3)c(C)n2)CCC1
InChIInChI=1S/C15H16N6O/c1-3-7-15(8-4-9-15)17-14(22)12-6-5-11(10(2)16-12)13-18-20-21-19-13/h1,5-6H,4,7-9H2,2H3,(H,17,22)(H,18,19,20,21)
InChIKeyZQWBIEJSQCNGRX-UHFFFAOYSA-N
XLogP1.25
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(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-[1-(hydroxymethyl)cyclobutyl]-4-(2H-tetrazol-5-yl)benzamide
CID 115878235
N-[1-(hydroxymethyl)cyclopropyl]-5,6-dimethylpyridine-2-carboxamide
CID 168957468
ethane;N-[1-(hydroxymethyl)cyclopropyl]-5,6-dimethylpyridine-2-carboxamide
CID 168957527
5-(1,4-diazepan-1-yl)-N-(1-prop-2-ynylcyclobutyl)pyrazine-2-carboxamide
CID 167745554
N-[1-(hydroxymethyl)cyclobutyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 113344802
6-(ethylamino)-N-(1-ethylcyclobutyl)pyridazine-3-carboxamide
CID 113489122
N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 55082531
N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide
CID 110008429
N-[1-(hydroxymethyl)cyclobutyl]-2H-benzotriazole-5-carboxamide
CID 115878496
CID 70476554
CID 70476554
N-[4-(4-methoxyphenyl)-3-(2H-tetrazol-5-yl)phenyl]-1-(4-methylphenyl)cyclopropane-1-carboxamide
CID 158054063
N-(1-cyanocyclopentyl)-6-methylpyridine-2-carboxamide
CID 60727656

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide (CID 166311917) is 6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide is C#CCC1(NC(=O)c2ccc(-c3nn[nH]n3)c(C)n2)CCC1.
What is the InChIKey of 6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The InChIKey is ZQWBIEJSQCNGRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O/c1-3-7-15(8-4-9-15)17-14(22)12-6-5-11(10(2)16-12)13-18-20-21-19-13/h1,5-6H,4,7-9H2,2H3,(H,17,22)(H,18,19,20,21).
What are the key properties of 6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide has a molecular weight of 296.33 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(1-prop-2-ynylcyclobutyl)-5-(2H-tetrazol-5-yl)pyridine-2-carboxamide is sourced from PubChem (CID 166311917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).