3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide

C15H17N3O — CID 91771821

IUPAC3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2ncccc2C)nc1
InChIInChI=1S/C15H17N3O/c1-10-6-7-13(17-9-10)12(3)18-15(19)14-11(2)5-4-8-16-14/h4-9,12H,1-3H3,(H,18,19)
InChIKeyMCRSWIZWUWOUBH-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.58
Rot. Bonds3

About 3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide

3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide (PubChem CID 91771821) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide
PubChem CID91771821
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2ncccc2C)nc1
InChIInChI=1S/C15H17N3O/c1-10-6-7-13(17-9-10)12(3)18-15(19)14-11(2)5-4-8-16-14/h4-9,12H,1-3H3,(H,18,19)
InChIKeyMCRSWIZWUWOUBH-UHFFFAOYSA-N
XLogP2.58
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-aminoethyl)-3-methylpyridine-2-carboxamide
CID 173067121
N-(1-hydroxypropan-2-yl)-3-methylpyridine-2-carboxamide
CID 62341368
N-(4-aminobutan-2-yl)-3-methylpyridine-2-carboxamide
CID 62340960
N-(4-hydroxybutan-2-yl)-3-methylpyridine-2-carboxamide
CID 115283439
(2R)-3-methyl-2-[(3-methylpyridine-2-carbonyl)amino]butanoic acid
CID 79011144
N-(1-bromo-4-methylpentan-2-yl)-3-methylpyridine-2-carboxamide
CID 114311647
(2S,3R)-3-hydroxy-2-[(3-methylpyridine-2-carbonyl)amino]butanoic acid
CID 94402027
N-(1-amino-1-sulfanylidenepropan-2-yl)-3-methylpyridine-2-carboxamide
CID 62339475
N-[(2S)-1-hydroxybutan-2-yl]-3-methylpyridine-2-carboxamide
CID 104981219
3-methyl-N-[1-(2-pyrazol-1-ylphenyl)ethyl]pyridine-2-carboxamide
CID 91773190
4-methyl-2-[1-[(3-methylpyridine-2-carbonyl)amino]ethyl]-1,3-thiazole-5-carboxylic acid
CID 120537651
(2R)-3-hydroxy-2-[(3-methylpyridine-2-carbonyl)amino]propanoic acid
CID 80750927

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide (CID 91771821) is 3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide is Cc1ccc(C(C)NC(=O)c2ncccc2C)nc1.
What is the InChIKey of 3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide?
The InChIKey is MCRSWIZWUWOUBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-10-6-7-13(17-9-10)12(3)18-15(19)14-11(2)5-4-8-16-14/h4-9,12H,1-3H3,(H,18,19).
What are the key properties of 3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide?
3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[1-(5-methyl-2-pyridinyl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 91771821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).