N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide

C16H19N3O — CID 62339323

IUPACN-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide
SMILESCCNCc1ccccc1NC(=O)c1ncccc1C
InChIInChI=1S/C16H19N3O/c1-3-17-11-13-8-4-5-9-14(13)19-16(20)15-12(2)7-6-10-18-15/h4-10,17H,3,11H2,1-2H3,(H,19,20)
InChIKeyNOSLJJDWNSKOSU-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.75
Rot. Bonds5

About N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide

N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide (PubChem CID 62339323) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide
PubChem CID62339323
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide
SMILESCCNCc1ccccc1NC(=O)c1ncccc1C
InChIInChI=1S/C16H19N3O/c1-3-17-11-13-8-4-5-9-14(13)19-16(20)15-12(2)7-6-10-18-15/h4-10,17H,3,11H2,1-2H3,(H,19,20)
InChIKeyNOSLJJDWNSKOSU-UHFFFAOYSA-N
XLogP2.75
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(ethylaminomethyl)phenyl]-2-methoxypyridine-3-carboxamide
CID 62873976
N-[2-(ethylaminomethyl)phenyl]-2-methyl-1,3-thiazole-5-carboxamide
CID 103805568
2-[[2-(methylaminomethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid
CID 63615270
N-[2-(ethylaminomethyl)phenyl]-3,5-dimethylbenzamide
CID 43601336
N-[2-(ethylaminomethyl)phenyl]-3,4-dimethylbenzamide;hydrochloride
CID 119440699
N-(2-carbamothioylphenyl)-3-methylpyridine-2-carboxamide
CID 62341176
3-methyl-N-(2-sulfamoylphenyl)pyridine-2-carboxamide
CID 62340174
N-[2-(ethylaminomethyl)phenyl]-1H-1,2,4-triazole-5-carboxamide
CID 63654524
3-[[2-(2-methylphenyl)acetyl]amino]pyridine-2-carboxylic acid
CID 104740245
N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide
CID 119439770
N-[2-(ethylaminomethyl)phenyl]-2,5-difluoro-4-methylbenzamide
CID 84589201
5-bromo-N-[2-(ethylaminomethyl)phenyl]-2-methylbenzamide
CID 65311478

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide?
The IUPAC name of N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide (CID 62339323) is N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide.
What is the SMILES notation for N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide?
The canonical SMILES for N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide is CCNCc1ccccc1NC(=O)c1ncccc1C.
What is the InChIKey of N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide?
The InChIKey is NOSLJJDWNSKOSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-3-17-11-13-8-4-5-9-14(13)19-16(20)15-12(2)7-6-10-18-15/h4-10,17H,3,11H2,1-2H3,(H,19,20).
What are the key properties of N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide?
N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylaminomethyl)phenyl]-3-methylpyridine-2-carboxamide is sourced from PubChem (CID 62339323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).