3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide

C16H30N2O — CID 63139513

IUPAC3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide
SMILESCC1CCC(C(C)C)C(NC(=O)C2(C)CCNC2)C1
InChIInChI=1S/C16H30N2O/c1-11(2)13-6-5-12(3)9-14(13)18-15(19)16(4)7-8-17-10-16/h11-14,17H,5-10H2,1-4H3,(H,18,19)
InChIKeyNQDCIRJIIKHALY-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.56
Rot. Bonds3

About 3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide

3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide (PubChem CID 63139513) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide
PubChem CID63139513
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide
SMILESCC1CCC(C(C)C)C(NC(=O)C2(C)CCNC2)C1
InChIInChI=1S/C16H30N2O/c1-11(2)13-6-5-12(3)9-14(13)18-15(19)16(4)7-8-17-10-16/h11-14,17H,5-10H2,1-4H3,(H,18,19)
InChIKeyNQDCIRJIIKHALY-UHFFFAOYSA-N
XLogP2.56
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide
CID 63121777
3-methyl-N-(4-methylcyclohexyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119779385
2-amino-1-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)cyclopentane-1-carboxamide
CID 82764226
2-methoxy-N-(5-methyl-2-propan-2-ylcyclohexyl)propanamide
CID 113225650
N-(1-azabicyclo[2.2.2]octan-3-yl)-3-methylpyrrolidine-3-carboxamide
CID 63138598
N-(2-ethylcyclohexyl)-3-methylpyrrolidine-3-carboxamide
CID 63139427
N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride
CID 119304535
N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methylpyrrolidine-3-carboxamide
CID 114629667
3-methyl-N-(thian-4-yl)pyrrolidine-3-carboxamide
CID 115738917
N-(4-aminocyclohexyl)-3-methylpyrrolidine-3-carboxamide
CID 63142128
N-[(1R)-1-cyclopentylethyl]-3-methylpyrrolidine-3-carboxamide
CID 81388379
2-(methylamino)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
CID 63552614

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide?
The IUPAC name of 3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide (CID 63139513) is 3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide is CC1CCC(C(C)C)C(NC(=O)C2(C)CCNC2)C1.
What is the InChIKey of 3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide?
The InChIKey is NQDCIRJIIKHALY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-11(2)13-6-5-12(3)9-14(13)18-15(19)16(4)7-8-17-10-16/h11-14,17H,5-10H2,1-4H3,(H,18,19).
What are the key properties of 3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide?
3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 2.56, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 63139513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).