3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine

C12H24N2 — CID 141446807

IUPAC3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine
SMILESCNN1CCC(CC2CCCCC2)C1
InChIInChI=1S/C12H24N2/c1-13-14-8-7-12(10-14)9-11-5-3-2-4-6-11/h11-13H,2-10H2,1H3
InChIKeyFEVFCKNSQCWFGX-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.41
Rot. Bonds3

About 3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine

3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine (PubChem CID 141446807) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine.

Molecular Properties

Compound Name3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine
PubChem CID141446807
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine
SMILESCNN1CCC(CC2CCCCC2)C1
InChIInChI=1S/C12H24N2/c1-13-14-8-7-12(10-14)9-11-5-3-2-4-6-11/h11-13H,2-10H2,1H3
InChIKeyFEVFCKNSQCWFGX-UHFFFAOYSA-N
XLogP2.41
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine?
The IUPAC name of 3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine (CID 141446807) is 3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine.
What is the SMILES notation for 3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine?
The canonical SMILES for 3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine is CNN1CCC(CC2CCCCC2)C1.
What is the InChIKey of 3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine?
The InChIKey is FEVFCKNSQCWFGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-13-14-8-7-12(10-14)9-11-5-3-2-4-6-11/h11-13H,2-10H2,1H3.
What are the key properties of 3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine?
3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine has a molecular weight of 196.34 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexylmethyl)-N-methylpyrrolidin-1-amine is sourced from PubChem (CID 141446807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).