(2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine

C11H22N2 — CID 18336856

IUPAC(2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine
SMILESCN(C1CCCCC1)[C@H]1CCCN1
InChIInChI=1S/C11H22N2/c1-13(11-8-5-9-12-11)10-6-3-2-4-7-10/h10-12H,2-9H2,1H3/t11-/m0/s1
InChIKeyRQCKQJAURNJADG-NSHDSACASA-N
MW182.31 g/mol
LogP1.96
Rot. Bonds2

About (2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine

(2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine (PubChem CID 18336856) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is (2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine.

Molecular Properties

Compound Name(2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine
PubChem CID18336856
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name(2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine
SMILESCN(C1CCCCC1)[C@H]1CCCN1
InChIInChI=1S/C11H22N2/c1-13(11-8-5-9-12-11)10-6-3-2-4-7-10/h10-12H,2-9H2,1H3/t11-/m0/s1
InChIKeyRQCKQJAURNJADG-NSHDSACASA-N
XLogP1.96
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine?
The IUPAC name of (2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine (CID 18336856) is (2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine.
What is the SMILES notation for (2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine?
The canonical SMILES for (2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine is CN(C1CCCCC1)[C@H]1CCCN1.
What is the InChIKey of (2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine?
The InChIKey is RQCKQJAURNJADG-NSHDSACASA-N. The full InChI is InChI=1S/C11H22N2/c1-13(11-8-5-9-12-11)10-6-3-2-4-7-10/h10-12H,2-9H2,1H3/t11-/m0/s1.
What are the key properties of (2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine?
(2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine has a molecular weight of 182.31 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclohexyl-N-methylpyrrolidin-2-amine is sourced from PubChem (CID 18336856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).