N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide

C20H25N3O — CID 109240823

IUPACN-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cncc(N2CCCC(C)C2)c1)c1ccccc1
InChIInChI=1S/C20H25N3O/c1-3-23(18-9-5-4-6-10-18)20(24)17-12-19(14-21-13-17)22-11-7-8-16(2)15-22/h4-6,9-10,12-14,16H,3,7-8,11,15H2,1-2H3
InChIKeyBWWVHDRWQLGRKT-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.98
Rot. Bonds4

About N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide

N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide (PubChem CID 109240823) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide
PubChem CID109240823
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC NameN-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cncc(N2CCCC(C)C2)c1)c1ccccc1
InChIInChI=1S/C20H25N3O/c1-3-23(18-9-5-4-6-10-18)20(24)17-12-19(14-21-13-17)22-11-7-8-16(2)15-22/h4-6,9-10,12-14,16H,3,7-8,11,15H2,1-2H3
InChIKeyBWWVHDRWQLGRKT-UHFFFAOYSA-N
XLogP3.98
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(3S)-3-methylpiperidin-1-yl]pyridine-3-carboxylic acid
CID 126422492
(4-benzylpiperazin-1-yl)-[5-(3-methylpiperidin-1-yl)-3-pyridinyl]methanone
CID 109237470
5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide
CID 109222844
(4-benzylpiperidin-1-yl)-[5-(3-methylpiperidin-1-yl)-3-pyridinyl]methanone
CID 109240472
5-(3-methylpiperidin-1-yl)-N-prop-2-enylpyridine-3-carboxamide
CID 109224030
5-(azepan-1-yl)-N-methyl-N-phenylpyridine-3-carboxamide
CID 109241324
3-N-cycloheptyl-5-N-ethyl-5-N-phenylpyridine-3,5-dicarboxamide
CID 109107040
N-ethyl-5-(N-ethylanilino)-N-phenylpyridine-3-carboxamide
CID 109243544
(3-methylpiperidin-1-yl)-(5-piperidin-1-yl-3-pyridinyl)methanone
CID 109226519
2-(azepan-1-yl)-N-ethyl-N-phenylpyrimidine-5-carboxamide
CID 109264971
N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109288895
N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide
CID 109108564

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide?
The IUPAC name of N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide (CID 109240823) is N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide?
The canonical SMILES for N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide is CCN(C(=O)c1cncc(N2CCCC(C)C2)c1)c1ccccc1.
What is the InChIKey of N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide?
The InChIKey is BWWVHDRWQLGRKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-3-23(18-9-5-4-6-10-18)20(24)17-12-19(14-21-13-17)22-11-7-8-16(2)15-22/h4-6,9-10,12-14,16H,3,7-8,11,15H2,1-2H3.
What are the key properties of N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide?
N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide has a molecular weight of 323.44 g/mol, XLogP of 3.98, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(3-methylpiperidin-1-yl)-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 109240823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).