3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide

C9H10N6O — CID 13209568

IUPAC3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
SMILESCc1ccc(C)c(C(=O)Nc2nn[nH]n2)n1
InChIInChI=1S/C9H10N6O/c1-5-3-4-6(2)10-7(5)8(16)11-9-12-14-15-13-9/h3-4H,1-2H3,(H2,11,12,13,14,15,16)
InChIKeyLHJISGNWCQKSCY-UHFFFAOYSA-N
MW218.22 g/mol
LogP0.46
Rot. Bonds2

About 3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide

3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide (PubChem CID 13209568) has the molecular formula C9H10N6O and a molecular weight of 218.22 g/mol. Its IUPAC name is 3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
PubChem CID13209568
Molecular FormulaC9H10N6O
Molecular Weight218.22 g/mol
Exact Mass218.09
IUPAC Name3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
SMILESCc1ccc(C)c(C(=O)Nc2nn[nH]n2)n1
InChIInChI=1S/C9H10N6O/c1-5-3-4-6(2)10-7(5)8(16)11-9-12-14-15-13-9/h3-4H,1-2H3,(H2,11,12,13,14,15,16)
InChIKeyLHJISGNWCQKSCY-UHFFFAOYSA-N
XLogP0.46
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

CID 70476554
CID 70476554
1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide
CID 3402764
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CID 70532578
2-(2-methylphenyl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide
CID 15623106
3-[(4,6-dimethylpyrimidin-2-yl)amino]-N-(2H-tetrazol-5-yl)benzamide
CID 71700893
2-methyl-N-(2H-tetrazol-5-yl)-1H-imidazole-5-carboxamide
CID 139628196
4-propan-2-yl-N-(2H-tetrazol-5-yl)benzamide
CID 5192520
N-(2H-tetrazol-5-yl)naphthalene-1-carboxamide
CID 5100620
2-(4-methoxyphenyl)-4-methyl-N-(2H-tetrazol-5-yl)-1,3-thiazole-5-carboxamide
CID 14772776
2-methyl-6-nitro-N-(2H-tetrazol-5-yl)benzamide
CID 13267886
3-methyl-2-nitro-N-(2H-tetrazol-5-yl)benzamide
CID 13267889
3,6-dimethylpyridine-2-carboxylic acid
CID 13209567

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The IUPAC name of 3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide (CID 13209568) is 3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The canonical SMILES for 3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide is Cc1ccc(C)c(C(=O)Nc2nn[nH]n2)n1.
What is the InChIKey of 3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
The InChIKey is LHJISGNWCQKSCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N6O/c1-5-3-4-6(2)10-7(5)8(16)11-9-12-14-15-13-9/h3-4H,1-2H3,(H2,11,12,13,14,15,16).
What are the key properties of 3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide?
3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide has a molecular weight of 218.22 g/mol, XLogP of 0.46, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide is sourced from PubChem (CID 13209568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).