(3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide

C12H22N2O — CID 89459284

IUPAC(3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide
SMILESC[C@@]1(C(=O)NC2CCCCC2)CCNC1
InChIInChI=1S/C12H22N2O/c1-12(7-8-13-9-12)11(15)14-10-5-3-2-4-6-10/h10,13H,2-9H2,1H3,(H,14,15)/t12-/m1/s1
InChIKeyIURAAUGEXAMJJM-GFCCVEGCSA-N
MW210.32 g/mol
LogP1.43
Rot. Bonds2

About (3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide

(3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide (PubChem CID 89459284) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is (3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide
PubChem CID89459284
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name(3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide
SMILESC[C@@]1(C(=O)NC2CCCCC2)CCNC1
InChIInChI=1S/C12H22N2O/c1-12(7-8-13-9-12)11(15)14-10-5-3-2-4-6-10/h10,13H,2-9H2,1H3,(H,14,15)/t12-/m1/s1
InChIKeyIURAAUGEXAMJJM-GFCCVEGCSA-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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Frequently Asked Questions

What is the IUPAC name of (3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide?
The IUPAC name of (3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide (CID 89459284) is (3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide is C[C@@]1(C(=O)NC2CCCCC2)CCNC1.
What is the InChIKey of (3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide?
The InChIKey is IURAAUGEXAMJJM-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H22N2O/c1-12(7-8-13-9-12)11(15)14-10-5-3-2-4-6-10/h10,13H,2-9H2,1H3,(H,14,15)/t12-/m1/s1.
What are the key properties of (3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide?
(3R)-N-cyclohexyl-3-methylpyrrolidine-3-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 (3R)-N-cyclohexyl-3-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 89459284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).