N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide

C14H26N2O — CID 102779573

IUPACN-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide
SMILESCC1CC(C)CC(NC(=O)C2NCCC2C)C1
InChIInChI=1S/C14H26N2O/c1-9-6-10(2)8-12(7-9)16-14(17)13-11(3)4-5-15-13/h9-13,15H,4-8H2,1-3H3,(H,16,17)
InChIKeyMPPQTWCFZNYXBG-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.93
Rot. Bonds2

About N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide

N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide (PubChem CID 102779573) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide
PubChem CID102779573
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide
SMILESCC1CC(C)CC(NC(=O)C2NCCC2C)C1
InChIInChI=1S/C14H26N2O/c1-9-6-10(2)8-12(7-9)16-14(17)13-11(3)4-5-15-13/h9-13,15H,4-8H2,1-3H3,(H,16,17)
InChIKeyMPPQTWCFZNYXBG-UHFFFAOYSA-N
XLogP1.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-(3-methylcyclobutyl)pyrrolidine-2-carboxamide
CID 102780045
N-(3-hydroxycyclobutyl)-3-methylpyrrolidine-2-carboxamide
CID 102779646
3-methyl-N-(oxetan-3-yl)pyrrolidine-2-carboxamide
CID 102779731
3-methyl-N-(1-oxothian-4-yl)pyrrolidine-2-carboxamide
CID 102780062
(2S,4S)-2-methyl-N-(3-methylcyclobutyl)piperidine-4-carboxamide
CID 120633929
N-(1-tert-butylpiperidin-4-yl)-3-methylpyrrolidine-2-carboxamide
CID 102778405
(2S)-N-(3,5-dimethylcyclohexyl)pyrrolidine-2-carboxamide
CID 64733303
(2R,3S)-2-methyl-N-(3-methylcyclobutyl)morpholine-3-carboxamide;hydrochloride
CID 120933471
3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide
CID 102779455
N-(2,2-diethyloxan-4-yl)-3-methylpyrrolidine-2-carboxamide
CID 102779942
(2R)-N-(3,5-dimethylcyclohexyl)piperidine-2-carboxamide
CID 103811701
N-(1-ethylsulfonylpiperidin-4-yl)-3-methylpyrrolidine-2-carboxamide
CID 102779102

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide?
The IUPAC name of N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide (CID 102779573) is N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide is CC1CC(C)CC(NC(=O)C2NCCC2C)C1.
What is the InChIKey of N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide?
The InChIKey is MPPQTWCFZNYXBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-9-6-10(2)8-12(7-9)16-14(17)13-11(3)4-5-15-13/h9-13,15H,4-8H2,1-3H3,(H,16,17).
What are the key properties of N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide?
N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 1.93, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylcyclohexyl)-3-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 102779573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).