N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide

C23H31N3O — CID 109217206

IUPACN-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide
SMILESCCC1CCCCN1c1ccnc(C(=O)N(Cc2ccccc2)C(C)C)c1
InChIInChI=1S/C23H31N3O/c1-4-20-12-8-9-15-25(20)21-13-14-24-22(16-21)23(27)26(18(2)3)17-19-10-6-5-7-11-19/h5-7,10-11,13-14,16,18,20H,4,8-9,12,15,17H2,1-3H3
InChIKeyGLJLNXUDCYMCLB-UHFFFAOYSA-N
MW365.52 g/mol
LogP4.90
Rot. Bonds6

About N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide

N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide (PubChem CID 109217206) has the molecular formula C23H31N3O and a molecular weight of 365.52 g/mol. Its IUPAC name is N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide
PubChem CID109217206
Molecular FormulaC23H31N3O
Molecular Weight365.52 g/mol
Exact Mass365.25
IUPAC NameN-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide
SMILESCCC1CCCCN1c1ccnc(C(=O)N(Cc2ccccc2)C(C)C)c1
InChIInChI=1S/C23H31N3O/c1-4-20-12-8-9-15-25(20)21-13-14-24-22(16-21)23(27)26(18(2)3)17-19-10-6-5-7-11-19/h5-7,10-11,13-14,16,18,20H,4,8-9,12,15,17H2,1-3H3
InChIKeyGLJLNXUDCYMCLB-UHFFFAOYSA-N
XLogP4.90
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.52
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-6-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridazine-3-carboxamide
CID 109125114
4-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109202928
N-benzyl-4-(cycloheptylamino)-N-propan-2-ylpyridine-2-carboxamide
CID 109217127
[4-(2-ethylpiperidin-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109203690
N-benzyl-5-(2-ethylpiperidin-1-yl)-N-methylpyridine-2-carboxamide
CID 109189130
[4-[4-(2-ethylpiperidin-1-yl)pyridine-2-carbonyl]piperazin-1-yl]-(furan-2-yl)methanone
CID 109216173
N-benzyl-2-(2-ethylpiperidin-1-yl)-2-oxo-N-propan-2-ylacetamide
CID 108503471
N-benzyl-N-propan-2-ylpyridine-2-carboxamide
CID 42778097
N-benzyl-4-(N-ethylanilino)-N-propan-2-ylpyridine-2-carboxamide
CID 109217216
2-N-benzyl-4-N-butan-2-yl-2-N-propan-2-ylpyridine-2,4-dicarboxamide
CID 109080007
N-benzyl-N-ethyl-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203831
N,N-diethyl-4-[2-(hydroxymethyl)pyrrolidin-1-yl]pyridine-2-carboxamide
CID 61409424

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide?
The IUPAC name of N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide (CID 109217206) is N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide.
What is the SMILES notation for N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide?
The canonical SMILES for N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide is CCC1CCCCN1c1ccnc(C(=O)N(Cc2ccccc2)C(C)C)c1.
What is the InChIKey of N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide?
The InChIKey is GLJLNXUDCYMCLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31N3O/c1-4-20-12-8-9-15-25(20)21-13-14-24-22(16-21)23(27)26(18(2)3)17-19-10-6-5-7-11-19/h5-7,10-11,13-14,16,18,20H,4,8-9,12,15,17H2,1-3H3.
What are the key properties of N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide?
N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide has a molecular weight of 365.52 g/mol, XLogP of 4.90, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridine-2-carboxamide is sourced from PubChem (CID 109217206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).