N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine

C15H30N2 — CID 81332750

IUPACN-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine
SMILESCCC(NC1CC(C)N(C)C1)C1CCCCC1
InChIInChI=1S/C15H30N2/c1-4-15(13-8-6-5-7-9-13)16-14-10-12(2)17(3)11-14/h12-16H,4-11H2,1-3H3
InChIKeyJZPBVSSJGCMVPA-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds4

About N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine

N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine (PubChem CID 81332750) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine
PubChem CID81332750
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine
SMILESCCC(NC1CC(C)N(C)C1)C1CCCCC1
InChIInChI=1S/C15H30N2/c1-4-15(13-8-6-5-7-9-13)16-14-10-12(2)17(3)11-14/h12-16H,4-11H2,1-3H3
InChIKeyJZPBVSSJGCMVPA-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine?
The IUPAC name of N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine (CID 81332750) is N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine.
What is the SMILES notation for N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine?
The canonical SMILES for N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine is CCC(NC1CC(C)N(C)C1)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine?
The InChIKey is JZPBVSSJGCMVPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-15(13-8-6-5-7-9-13)16-14-10-12(2)17(3)11-14/h12-16H,4-11H2,1-3H3.
What are the key properties of N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine?
N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine has a molecular weight of 238.42 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylpropyl)-1,5-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 81332750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).