1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide

C14H24N2O2 — CID 104750574

IUPAC1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1CC(=O)C1CCCCC1
InChIInChI=1S/C14H24N2O2/c1-15-14(18)12-8-5-9-16(12)10-13(17)11-6-3-2-4-7-11/h11-12H,2-10H2,1H3,(H,15,18)
InChIKeyZULBRNMIRHEULH-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.35
Rot. Bonds4

About 1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide

1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide (PubChem CID 104750574) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide
PubChem CID104750574
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1CC(=O)C1CCCCC1
InChIInChI=1S/C14H24N2O2/c1-15-14(18)12-8-5-9-16(12)10-13(17)11-6-3-2-4-7-11/h11-12H,2-10H2,1H3,(H,15,18)
InChIKeyZULBRNMIRHEULH-UHFFFAOYSA-N
XLogP1.35
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-methyl-1-propylpyrrolidine-2-carboxamide
CID 142459881
(2S)-1-(2,2-dimethylpropyl)-N-methylpyrrolidine-2-carboxamide
CID 140912286
1-but-3-ynyl-N-methylpiperidine-2-carboxamide
CID 63656435
1-(2-aminopropyl)-N-methylpiperidine-2-carboxamide
CID 102688966
1-[2-(4-fluorophenyl)-2-oxoethyl]-N-methylpiperidine-2-carboxamide
CID 62035887
N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide
CID 62036084
1-[2-(2-hydroxyethoxy)ethyl]-N-methylpiperidine-2-carboxamide
CID 111439529
1-cyclopentyl-2-(2-ethylpyrrolidin-1-yl)ethanone
CID 104750099
1-[(2-hydroxyphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 82978861
1-[2-(5-ethylthiophen-2-yl)-2-oxoethyl]-N-methylpiperidine-2-carboxamide
CID 62037634
1-[2-(4-methoxyphenyl)-2-oxoethyl]-N-methylpyrrolidine-2-carboxamide
CID 62030100
1-acetyl-N-methylpiperidine-2-carboxamide
CID 10607550

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide (CID 104750574) is 1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide is CNC(=O)C1CCCN1CC(=O)C1CCCCC1.
What is the InChIKey of 1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide?
The InChIKey is ZULBRNMIRHEULH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-15-14(18)12-8-5-9-16(12)10-13(17)11-6-3-2-4-7-11/h11-12H,2-10H2,1H3,(H,15,18).
What are the key properties of 1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide?
1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide has a molecular weight of 252.36 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 104750574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).