N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide

C12H22N2O — CID 18072889

IUPACN-(4-methylcyclohexyl)pyrrolidine-2-carboxamide
SMILESCC1CCC(NC(=O)C2CCCN2)CC1
InChIInChI=1S/C12H22N2O/c1-9-4-6-10(7-5-9)14-12(15)11-3-2-8-13-11/h9-11,13H,2-8H2,1H3,(H,14,15)
InChIKeyGPETVILHQBKOJK-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.43
Rot. Bonds2

About N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide

N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide (PubChem CID 18072889) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)pyrrolidine-2-carboxamide
PubChem CID18072889
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-(4-methylcyclohexyl)pyrrolidine-2-carboxamide
SMILESCC1CCC(NC(=O)C2CCCN2)CC1
InChIInChI=1S/C12H22N2O/c1-9-4-6-10(7-5-9)14-12(15)11-3-2-8-13-11/h9-11,13H,2-8H2,1H3,(H,14,15)
InChIKeyGPETVILHQBKOJK-UHFFFAOYSA-N
XLogP1.43
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride
CID 66855012
(2S)-N-(3,5-dimethylcyclohexyl)pyrrolidine-2-carboxamide
CID 64733303
N-(4-propylcyclohexyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119304208
N-cyclopentylazepane-2-carboxamide
CID 64564743
(2R)-N-(3,5-dimethylcyclohexyl)piperidine-2-carboxamide
CID 103811701
N-(thian-4-yl)pyrrolidine-2-carboxamide
CID 115626530
N-(4-methylcyclohexyl)thiomorpholine-3-carboxamide
CID 82905560
N-(4-methylsulfanylcyclohexyl)piperidine-2-carboxamide
CID 114123028
(2S)-N-(2,4-dimethylcyclohexyl)pyrrolidine-2-carboxamide
CID 63997751
(2S)-N-cyclopent-3-en-1-ylpyrrolidine-2-carboxamide
CID 104863890
(2S)-N-pyrrolidin-3-ylpyrrolidine-2-carboxamide
CID 130690073
N-(4-aminocyclohexyl)azepane-2-carboxamide
CID 64569941

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide (CID 18072889) is N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide is CC1CCC(NC(=O)C2CCCN2)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide?
The InChIKey is GPETVILHQBKOJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-9-4-6-10(7-5-9)14-12(15)11-3-2-8-13-11/h9-11,13H,2-8H2,1H3,(H,14,15).
What are the key properties of N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide?
N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide has a molecular weight of 210.32 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 18072889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).