4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide

C15H28N2O — CID 63714005

IUPAC4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide
SMILESCCCC1CCC(NC(=O)C2CNCC2C)CC1
InChIInChI=1S/C15H28N2O/c1-3-4-12-5-7-13(8-6-12)17-15(18)14-10-16-9-11(14)2/h11-14,16H,3-10H2,1-2H3,(H,17,18)
InChIKeyCSUDMSFISRAUJX-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.32
Rot. Bonds4

About 4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide

4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide (PubChem CID 63714005) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide
PubChem CID63714005
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide
SMILESCCCC1CCC(NC(=O)C2CNCC2C)CC1
InChIInChI=1S/C15H28N2O/c1-3-4-12-5-7-13(8-6-12)17-15(18)14-10-16-9-11(14)2/h11-14,16H,3-10H2,1-2H3,(H,17,18)
InChIKeyCSUDMSFISRAUJX-UHFFFAOYSA-N
XLogP2.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-propylcyclohexyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 54962940
4-[(4-methylpyrrolidine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 63715319
N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide
CID 63715986
(3S,4S)-N-(4,4-dimethylcyclohexyl)-4-methylpyrrolidine-3-carboxamide
CID 114084930
4-methyl-N-(2-methylpentan-2-yl)pyrrolidine-3-carboxamide
CID 115747606
N-[3-(cyclopropylamino)-3-oxopropyl]-4-methylpyrrolidine-3-carboxamide
CID 79400917
N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide
CID 55228814
N-cyclopent-3-en-1-yl-4-methylpyrrolidine-3-carboxamide
CID 115976512
(3S,4S)-4-methyl-N-(1-methylazetidin-3-yl)pyrrolidine-3-carboxamide
CID 131204171
(3S,4S)-N-cyclopent-3-en-1-yl-4-methylpyrrolidine-3-carboxamide;hydrochloride
CID 131110722
(3S,4S)-N-(2-ethylcyclopropyl)-4-methylpyrrolidine-3-carboxamide;hydrochloride
CID 130908536
N-[4-(cyclopropylamino)-4-oxobutyl]-4-methylpyrrolidine-3-carboxamide
CID 79401380

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide?
The IUPAC name of 4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide (CID 63714005) is 4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide is CCCC1CCC(NC(=O)C2CNCC2C)CC1.
What is the InChIKey of 4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide?
The InChIKey is CSUDMSFISRAUJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-3-4-12-5-7-13(8-6-12)17-15(18)14-10-16-9-11(14)2/h11-14,16H,3-10H2,1-2H3,(H,17,18).
What are the key properties of 4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide?
4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide has a molecular weight of 252.40 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 63714005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).