1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine

C15H30N2 — CID 81329081

IUPAC1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine
SMILESCCCC1CCC(NC2CC(C)N(C)C2)CC1
InChIInChI=1S/C15H30N2/c1-4-5-13-6-8-14(9-7-13)16-15-10-12(2)17(3)11-15/h12-16H,4-11H2,1-3H3
InChIKeyLHSLJVXOMHDEGC-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds4

About 1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine

1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine (PubChem CID 81329081) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine
PubChem CID81329081
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine
SMILESCCCC1CCC(NC2CC(C)N(C)C2)CC1
InChIInChI=1S/C15H30N2/c1-4-5-13-6-8-14(9-7-13)16-15-10-12(2)17(3)11-15/h12-16H,4-11H2,1-3H3
InChIKeyLHSLJVXOMHDEGC-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 1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine?
The IUPAC name of 1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine (CID 81329081) is 1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine.
What is the SMILES notation for 1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine?
The canonical SMILES for 1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine is CCCC1CCC(NC2CC(C)N(C)C2)CC1.
What is the InChIKey of 1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine?
The InChIKey is LHSLJVXOMHDEGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-5-13-6-8-14(9-7-13)16-15-10-12(2)17(3)11-15/h12-16H,4-11H2,1-3H3.
What are the key properties of 1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine?
1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-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 1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine is sourced from PubChem (CID 81329081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).