6-benzyl-N-methylpyridine-2-carboxamide

C14H14N2O — CID 164623776

IUPAC6-benzyl-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cccc(Cc2ccccc2)n1
InChIInChI=1S/C14H14N2O/c1-15-14(17)13-9-5-8-12(16-13)10-11-6-3-2-4-7-11/h2-9H,10H2,1H3,(H,15,17)
InChIKeyINZCSVVZDUIXSN-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.03
Rot. Bonds3

About 6-benzyl-N-methylpyridine-2-carboxamide

6-benzyl-N-methylpyridine-2-carboxamide (PubChem CID 164623776) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is 6-benzyl-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-benzyl-N-methylpyridine-2-carboxamide
PubChem CID164623776
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC Name6-benzyl-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cccc(Cc2ccccc2)n1
InChIInChI=1S/C14H14N2O/c1-15-14(17)13-9-5-8-12(16-13)10-11-6-3-2-4-7-11/h2-9H,10H2,1H3,(H,15,17)
InChIKeyINZCSVVZDUIXSN-UHFFFAOYSA-N
XLogP2.03
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-benzyl-N-methylpyridine-2-carboxamide?
The IUPAC name of 6-benzyl-N-methylpyridine-2-carboxamide (CID 164623776) is 6-benzyl-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 6-benzyl-N-methylpyridine-2-carboxamide?
The canonical SMILES for 6-benzyl-N-methylpyridine-2-carboxamide is CNC(=O)c1cccc(Cc2ccccc2)n1.
What is the InChIKey of 6-benzyl-N-methylpyridine-2-carboxamide?
The InChIKey is INZCSVVZDUIXSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-15-14(17)13-9-5-8-12(16-13)10-11-6-3-2-4-7-11/h2-9H,10H2,1H3,(H,15,17).
What are the key properties of 6-benzyl-N-methylpyridine-2-carboxamide?
6-benzyl-N-methylpyridine-2-carboxamide has a molecular weight of 226.28 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-benzyl-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 164623776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).