N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide

C10H12N6O — CID 110871101

IUPACN-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide
SMILESCN(Cc1nnnn1C)C(=O)c1ccncc1
InChIInChI=1S/C10H12N6O/c1-15(7-9-12-13-14-16(9)2)10(17)8-3-5-11-6-4-8/h3-6H,7H2,1-2H3
InChIKeyIYTVUWRHEJJSDE-UHFFFAOYSA-N
MW232.25 g/mol
LogP-0.12
Rot. Bonds3

About N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide

N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide (PubChem CID 110871101) has the molecular formula C10H12N6O and a molecular weight of 232.25 g/mol. Its IUPAC name is N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide
PubChem CID110871101
Molecular FormulaC10H12N6O
Molecular Weight232.25 g/mol
Exact Mass232.11
IUPAC NameN-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide
SMILESCN(Cc1nnnn1C)C(=O)c1ccncc1
InChIInChI=1S/C10H12N6O/c1-15(7-9-12-13-14-16(9)2)10(17)8-3-5-11-6-4-8/h3-6H,7H2,1-2H3
InChIKeyIYTVUWRHEJJSDE-UHFFFAOYSA-N
XLogP-0.12
TPSA76.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 5-0.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N,2,2-trimethyl-N-[(1-methyltetrazol-5-yl)methyl]propanamide
CID 110871072
N-benzyl-N-methylpyridine-4-carboxamide
CID 7038821
N-methyl-N-[[1-(2-phenylethyl)benzimidazol-2-yl]methyl]pyridine-4-carboxamide
CID 16965732
N-methyl-N-[(1-undecylbenzimidazol-2-yl)methyl]pyridine-4-carboxamide
CID 16965703
N-[(1-heptylbenzimidazol-2-yl)methyl]-N-methylpyridine-4-carboxamide
CID 16965699
N-(2,2-dimethylpropyl)-N-methylpyridine-4-carboxamide
CID 84515347
N-methyl-N-(2-piperidin-1-ylethyl)pyridine-4-carboxamide
CID 110753397
N-butyl-N-methylpyridine-4-carboxamide;hydrochloride
CID 110756274
N-[(2-bromo-4-fluorophenyl)methyl]-N-methylpyridine-4-carboxamide
CID 91652849
N-methyl-N-(2-piperazin-1-ylethyl)pyridine-4-carboxamide
CID 63265506
(5-bromo-3-methyltriazol-4-yl)-pyridin-4-ylmethanone
CID 106461467
N-(3-amino-2,2-dimethylpropyl)-N-methylpyridine-4-carboxamide;dihydrochloride
CID 119653576

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide?
The IUPAC name of N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide (CID 110871101) is N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide?
The canonical SMILES for N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide is CN(Cc1nnnn1C)C(=O)c1ccncc1.
What is the InChIKey of N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide?
The InChIKey is IYTVUWRHEJJSDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O/c1-15(7-9-12-13-14-16(9)2)10(17)8-3-5-11-6-4-8/h3-6H,7H2,1-2H3.
What are the key properties of N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide?
N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide has a molecular weight of 232.25 g/mol, XLogP of -0.12, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1-methyltetrazol-5-yl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 110871101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).