1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one

C22H30N4O2 — CID 56894066

IUPAC1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one
SMILESCCn1c(C)ccc(C(=O)N2CCCC(N(C)CCc3ccccn3)C2)c1=O
InChIInChI=1S/C22H30N4O2/c1-4-26-17(2)10-11-20(22(26)28)21(27)25-14-7-9-19(16-25)24(3)15-12-18-8-5-6-13-23-18/h5-6,8,10-11,13,19H,4,7,9,12,14-16H2,1-3H3
InChIKeyGTIBVHOEKQATKX-UHFFFAOYSA-N
MW382.51 g/mol
LogP2.35
Rot. Bonds6

About 1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one

1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one (PubChem CID 56894066) has the molecular formula C22H30N4O2 and a molecular weight of 382.51 g/mol. Its IUPAC name is 1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one.

Molecular Properties

Compound Name1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one
PubChem CID56894066
Molecular FormulaC22H30N4O2
Molecular Weight382.51 g/mol
Exact Mass382.24
IUPAC Name1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one
SMILESCCn1c(C)ccc(C(=O)N2CCCC(N(C)CCc3ccccn3)C2)c1=O
InChIInChI=1S/C22H30N4O2/c1-4-26-17(2)10-11-20(22(26)28)21(27)25-14-7-9-19(16-25)24(3)15-12-18-8-5-6-13-23-18/h5-6,8,10-11,13,19H,4,7,9,12,14-16H2,1-3H3
InChIKeyGTIBVHOEKQATKX-UHFFFAOYSA-N
XLogP2.35
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.51
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one with MolForge

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Related Compounds

2-(4-ethylpiperazin-1-yl)-1-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidin-1-yl]ethanone
CID 45179784
[3-[methyl(2-pyridin-2-ylethyl)amino]piperidin-1-yl]-(4-methyl-1H-pyrrol-2-yl)methanone
CID 56912433
[(3S)-3-[methyl(2-pyridin-2-ylethyl)amino]piperidin-1-yl]-(5-propan-2-ylthiophen-3-yl)methanone
CID 95727240
(2-benzyl-1,3-thiazol-4-yl)-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidin-1-yl]methanone
CID 56701731
methyl 4-[[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]amino]benzoate
CID 45234205
3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)piperidine-1-carbonyl]-1-ethyl-6-methylpyridin-2-one
CID 56891876
(3S)-N-methyl-1-(6-methylpyridazin-3-yl)-N-(2-pyridin-2-ylethyl)piperidin-3-amine
CID 95757599
1-ethyl-6-methyl-3-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]pyridin-2-one
CID 70717837
(3R)-1-(benzenesulfonyl)-N-methyl-N-(2-pyridin-2-ylethyl)piperidin-3-amine
CID 42521946
1-ethyl-3-[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidine-1-carbonyl]-6-methylpyridin-2-one
CID 95552185
1-[(3R)-3-[methyl(pyridin-2-ylmethyl)amino]piperidin-1-yl]prop-2-en-1-one
CID 166764311
4-[[4-fluoro-3-[(3R)-3-[methyl(2-pyridin-2-ylethyl)amino]pyrrolidine-1-carbonyl]phenyl]methyl]-2H-phthalazin-1-one
CID 122441444

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one?
The IUPAC name of 1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one (CID 56894066) is 1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one.
What is the SMILES notation for 1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one?
The canonical SMILES for 1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one is CCn1c(C)ccc(C(=O)N2CCCC(N(C)CCc3ccccn3)C2)c1=O.
What is the InChIKey of 1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one?
The InChIKey is GTIBVHOEKQATKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O2/c1-4-26-17(2)10-11-20(22(26)28)21(27)25-14-7-9-19(16-25)24(3)15-12-18-8-5-6-13-23-18/h5-6,8,10-11,13,19H,4,7,9,12,14-16H2,1-3H3.
What are the key properties of 1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one?
1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one has a molecular weight of 382.51 g/mol, XLogP of 2.35, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-methyl-3-[3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]pyridin-2-one is sourced from PubChem (CID 56894066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).