3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide

C11H19N3O2 — CID 102779455

IUPAC3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide
SMILESCC1CCNC1C(=O)NC1CCC(=O)NC1
InChIInChI=1S/C11H19N3O2/c1-7-4-5-12-10(7)11(16)14-8-2-3-9(15)13-6-8/h7-8,10,12H,2-6H2,1H3,(H,13,15)(H,14,16)
InChIKeyULPHJYKKIOAULN-UHFFFAOYSA-N
MW225.29 g/mol
LogP-0.62
Rot. Bonds2

About 3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide

3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide (PubChem CID 102779455) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide
PubChem CID102779455
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide
SMILESCC1CCNC1C(=O)NC1CCC(=O)NC1
InChIInChI=1S/C11H19N3O2/c1-7-4-5-12-10(7)11(16)14-8-2-3-9(15)13-6-8/h7-8,10,12H,2-6H2,1H3,(H,13,15)(H,14,16)
InChIKeyULPHJYKKIOAULN-UHFFFAOYSA-N
XLogP-0.62
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 5-0.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-(3-methylcyclobutyl)pyrrolidine-2-carboxamide
CID 102780045
N-(6-oxopiperidin-3-yl)pyrrolidine-3-carboxamide
CID 63663368
3-methyl-N-(oxetan-3-yl)pyrrolidine-2-carboxamide
CID 102779731
N-(3-hydroxycyclobutyl)-3-methylpyrrolidine-2-carboxamide
CID 102779646
N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide
CID 102779573
5-amino-2,4-dimethyl-N-(6-oxopiperidin-3-yl)cyclohexane-1-carboxamide
CID 102706749
(6-oxopiperidin-3-yl)carbamic acid
CID 77299994
3-methyl-N-(1-oxothian-4-yl)pyrrolidine-2-carboxamide
CID 102780062
1,1-dimethyl-3-(6-oxopiperidin-3-yl)urea
CID 78916658
2,2-dimethyl-3-[(6-oxopiperidin-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 64836966
N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide
CID 78990985
2-(methylamino)-N-(6-oxopiperidin-3-yl)propanamide
CID 63663000

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide?
The IUPAC name of 3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide (CID 102779455) is 3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for 3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide is CC1CCNC1C(=O)NC1CCC(=O)NC1.
What is the InChIKey of 3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide?
The InChIKey is ULPHJYKKIOAULN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-7-4-5-12-10(7)11(16)14-8-2-3-9(15)13-6-8/h7-8,10,12H,2-6H2,1H3,(H,13,15)(H,14,16).
What are the key properties of 3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide?
3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide has a molecular weight of 225.29 g/mol, XLogP of -0.62, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 102779455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).