1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one

C21H30N4O2 — CID 75463755

IUPAC1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one
SMILESCC1CCCN(C(=O)c2ccc(N3CCC(N4CCCC4=O)CC3)nc2)C1
InChIInChI=1S/C21H30N4O2/c1-16-4-2-10-24(15-16)21(27)17-6-7-19(22-14-17)23-12-8-18(9-13-23)25-11-3-5-20(25)26/h6-7,14,16,18H,2-5,8-13,15H2,1H3
InChIKeyMIYNUZNDOUNKKV-UHFFFAOYSA-N
MW370.50 g/mol
LogP2.54
Rot. Bonds3

About 1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one

1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one (PubChem CID 75463755) has the molecular formula C21H30N4O2 and a molecular weight of 370.50 g/mol. Its IUPAC name is 1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one
PubChem CID75463755
Molecular FormulaC21H30N4O2
Molecular Weight370.50 g/mol
Exact Mass370.24
IUPAC Name1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one
SMILESCC1CCCN(C(=O)c2ccc(N3CCC(N4CCCC4=O)CC3)nc2)C1
InChIInChI=1S/C21H30N4O2/c1-16-4-2-10-24(15-16)21(27)17-6-7-19(22-14-17)23-12-8-18(9-13-23)25-11-3-5-20(25)26/h6-7,14,16,18H,2-5,8-13,15H2,1H3
InChIKeyMIYNUZNDOUNKKV-UHFFFAOYSA-N
XLogP2.54
TPSA56.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3-methylpiperidin-1-yl)-[6-(4-pyrimidin-2-ylpiperazin-1-yl)-3-pyridinyl]methanone
CID 109160628
[4-(3-methylpiperidin-1-yl)piperidin-1-yl]-(6-morpholin-4-yl-3-pyridinyl)methanone
CID 123921823
(3-methylpiperidin-1-yl)-(6-pyrazol-1-yl-3-pyridinyl)methanone
CID 53014451
1-[6-(azepan-1-yl)pyridine-3-carbonyl]piperidine-3-carboxylic acid
CID 102554636
[(3R)-3-(methoxymethyl)piperidin-1-yl]-[6-[4-(methoxymethyl)piperidin-1-yl]-3-pyridinyl]methanone
CID 28957540
(3-aminopiperidin-1-yl)-[6-(azepan-1-yl)-3-pyridinyl]methanone
CID 119378158
(3-aminopiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone;dihydrochloride
CID 119378111
[6-(3-methylpiperidin-1-yl)-3-pyridinyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 109160667
(4-aminopiperidin-1-yl)-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]methanone
CID 119374279
1-[1-(5-methylsulfanyl-2-pyridinyl)pyrrolidin-3-yl]pyrrolidin-2-one
CID 91602124
(3-methylpiperidin-1-yl)-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]methanone
CID 109262221
[(3S)-3-(2-methylimidazol-1-yl)piperidin-1-yl]-(6-pyrrolidin-1-yl-3-pyridinyl)methanone
CID 95332115

Frequently Asked Questions

What is the IUPAC name of 1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one?
The IUPAC name of 1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one (CID 75463755) is 1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one.
What is the SMILES notation for 1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one?
The canonical SMILES for 1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one is CC1CCCN(C(=O)c2ccc(N3CCC(N4CCCC4=O)CC3)nc2)C1.
What is the InChIKey of 1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one?
The InChIKey is MIYNUZNDOUNKKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O2/c1-16-4-2-10-24(15-16)21(27)17-6-7-19(22-14-17)23-12-8-18(9-13-23)25-11-3-5-20(25)26/h6-7,14,16,18H,2-5,8-13,15H2,1H3.
What are the key properties of 1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one?
1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one has a molecular weight of 370.50 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[5-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one is sourced from PubChem (CID 75463755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).