N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide

C17H21N3O — CID 78845972

IUPACN-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)NC(CN(C)C)c2ccccc2)n1
InChIInChI=1S/C17H21N3O/c1-13-8-7-11-15(18-13)17(21)19-16(12-20(2)3)14-9-5-4-6-10-14/h4-11,16H,12H2,1-3H3,(H,19,21)
InChIKeyFMHWTLQYUWBQSB-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.42
Rot. Bonds5

About N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide

N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide (PubChem CID 78845972) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide
PubChem CID78845972
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC NameN-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)NC(CN(C)C)c2ccccc2)n1
InChIInChI=1S/C17H21N3O/c1-13-8-7-11-15(18-13)17(21)19-16(12-20(2)3)14-9-5-4-6-10-14/h4-11,16H,12H2,1-3H3,(H,19,21)
InChIKeyFMHWTLQYUWBQSB-UHFFFAOYSA-N
XLogP2.42
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-2-carboxamide
CID 63184440
(2S)-2-[(6-methylpyridine-2-carbonyl)amino]-2-phenylacetic acid
CID 30071507
N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide
CID 78819640
1-benzyl-N-[2-(dimethylamino)-1-phenylethyl]triazole-4-carboxamide
CID 86917770
(2S)-2-[(6-methylpyridine-2-carbonyl)amino]-3-phenylpropanoic acid
CID 30075662
N-[1-(4-methoxyphenyl)propyl]-6-methylpyridine-2-carboxamide
CID 134001680
6-(1-phenylpropylcarbamoyl)pyridine-2-carboxylic acid
CID 62304057
N-[2-(dimethylamino)-1-phenylethyl]-3-methylthiophene-2-carboxamide
CID 86909665
N-[(1R)-2-(dimethylamino)-1-phenylethyl]-5-methyl-1-phenylpyrazole-4-carboxamide
CID 34464052
6-chloro-N-(2-hydroxy-1-phenylethyl)pyridine-2-carboxamide
CID 55160768
4-chloro-N-[(1R)-2-(dimethylamino)-1-phenylethyl]benzamide
CID 8936052
3-[(6-methylpyridine-2-carbonyl)amino]-2-phenylpropanoic acid
CID 62884347

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide (CID 78845972) is N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide is Cc1cccc(C(=O)NC(CN(C)C)c2ccccc2)n1.
What is the InChIKey of N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide?
The InChIKey is FMHWTLQYUWBQSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-13-8-7-11-15(18-13)17(21)19-16(12-20(2)3)14-9-5-4-6-10-14/h4-11,16H,12H2,1-3H3,(H,19,21).
What are the key properties of N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide?
N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide has a molecular weight of 283.38 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 78845972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).