6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one

C19H26N4O2 — CID 164632313

IUPAC6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one
SMILESCCc1[nH]c(=O)c(C(=O)N2CCCC[C@H]2c2cncn2CC)cc1C
InChIInChI=1S/C19H26N4O2/c1-4-15-13(3)10-14(18(24)21-15)19(25)23-9-7-6-8-16(23)17-11-20-12-22(17)5-2/h10-12,16H,4-9H2,1-3H3,(H,21,24)/t16-/m0/s1
InChIKeyUGPSNASHVMZKBD-INIZCTEOSA-N
MW342.44 g/mol
LogP2.83
Rot. Bonds4

About 6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one

6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one (PubChem CID 164632313) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is 6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one
PubChem CID164632313
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one
SMILESCCc1[nH]c(=O)c(C(=O)N2CCCC[C@H]2c2cncn2CC)cc1C
InChIInChI=1S/C19H26N4O2/c1-4-15-13(3)10-14(18(24)21-15)19(25)23-9-7-6-8-16(23)17-11-20-12-22(17)5-2/h10-12,16H,4-9H2,1-3H3,(H,21,24)/t16-/m0/s1
InChIKeyUGPSNASHVMZKBD-INIZCTEOSA-N
XLogP2.83
TPSA70.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one with MolForge

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Related Compounds

1-[2-(3-Methylimidazol-4-yl)piperidin-1-yl]prop-2-en-1-one
CID 146081021
3-{4-[2-(2-Cyclobutyl-5-methyl-1H-imidazol-1-YL)ethyl]piperidine-1-carbonyl}-6-methylpyridin-2-OL
CID 124077660
(6S)-N-[(1,6-dimethyl-2-oxo-3-pyridinyl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
CID 164638285
4-[[3-[(4-Fluorocyclohexa-1,3-dien-1-yl)methyl]imidazol-4-yl]methyl]piperazin-2-one
CID 144844506
2-fluoro-N,3-dimethyl-N-[[(2R,3S)-1-methyl-2-(3-methylimidazol-4-yl)piperidin-3-yl]methyl]but-2-enamide
CID 137844223
2-[3-[2-(3-Methylimidazol-4-yl)piperidine-1-carbonyl]-2-oxo-1-pyridinyl]acetic acid;2,2,2-trifluoroacetic acid
CID 138028685
3-(5,6-dihydroimidazo[1,5-a]pyrazin-7(8H)-ylcarbonyl)-6-ethyl-1,5-dimethylpyridin-2(1H)-one
CID 56902271
1-butyl-N-[2-(1H-imidazol-5-yl)ethyl]-2-oxo-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carboxamide
CID 23587730
5-[(1-propylimidazol-4-yl)methyl]-2,3-dihydro-1H-pyridin-6-one
CID 89448132
2-amino-1-[2-(5-propyl-1H-imidazol-2-yl)-3,4,6,7-tetrahydro-2H-quinolin-1-yl]propan-1-one
CID 142138705
ethane;methoxymethane;(3Z)-N-[1-[(3Z,5Z)-2-methylidenehepta-3,5-dienyl]piperidin-3-yl]-5-(4-methylimidazol-1-yl)hexa-3,5-dienamide;prop-1-ene
CID 144186155
6-[[4-(dimethylamino)cyclohexyl]methyl-ethylamino]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-7-methyl-4-(1-methylimidazol-4-yl)cyclohepta-1,4,6-triene-1-carboxamide
CID 163912247

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one?
The IUPAC name of 6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one (CID 164632313) is 6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one.
What is the SMILES notation for 6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one?
The canonical SMILES for 6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one is CCc1[nH]c(=O)c(C(=O)N2CCCC[C@H]2c2cncn2CC)cc1C.
What is the InChIKey of 6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one?
The InChIKey is UGPSNASHVMZKBD-INIZCTEOSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-4-15-13(3)10-14(18(24)21-15)19(25)23-9-7-6-8-16(23)17-11-20-12-22(17)5-2/h10-12,16H,4-9H2,1-3H3,(H,21,24)/t16-/m0/s1.
What are the key properties of 6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one?
6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one has a molecular weight of 342.44 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3-[(2S)-2-(3-ethylimidazol-4-yl)piperidine-1-carbonyl]-5-methyl-1H-pyridin-2-one is sourced from PubChem (CID 164632313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).