N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide

C13H24N2O — CID 63140509

IUPACN-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCN(C(=O)C1(C)CCNC1)C1CCCCC1
InChIInChI=1S/C13H24N2O/c1-13(8-9-14-10-13)12(16)15(2)11-6-4-3-5-7-11/h11,14H,3-10H2,1-2H3
InChIKeyAIRMFKACWINHDE-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.78
Rot. Bonds2

About N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide

N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide (PubChem CID 63140509) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide
PubChem CID63140509
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCN(C(=O)C1(C)CCNC1)C1CCCCC1
InChIInChI=1S/C13H24N2O/c1-13(8-9-14-10-13)12(16)15(2)11-6-4-3-5-7-11/h11,14H,3-10H2,1-2H3
InChIKeyAIRMFKACWINHDE-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide?
The IUPAC name of N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide (CID 63140509) is N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide is CN(C(=O)C1(C)CCNC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide?
The InChIKey is AIRMFKACWINHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-13(8-9-14-10-13)12(16)15(2)11-6-4-3-5-7-11/h11,14H,3-10H2,1-2H3.
What are the key properties of N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide?
N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N,3-dimethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63140509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).