N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine

C15H30N2 — CID 64751703

IUPACN-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine
SMILESCCCN(C1CCNC1)C1CC(C)CC(C)C1
InChIInChI=1S/C15H30N2/c1-4-7-17(14-5-6-16-11-14)15-9-12(2)8-13(3)10-15/h12-16H,4-11H2,1-3H3
InChIKeyLHKPNBLOLKOJDX-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.88
Rot. Bonds4

About N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine

N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine (PubChem CID 64751703) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine
PubChem CID64751703
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine
SMILESCCCN(C1CCNC1)C1CC(C)CC(C)C1
InChIInChI=1S/C15H30N2/c1-4-7-17(14-5-6-16-11-14)15-9-12(2)8-13(3)10-15/h12-16H,4-11H2,1-3H3
InChIKeyLHKPNBLOLKOJDX-UHFFFAOYSA-N
XLogP2.88
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 ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylcyclobutyl)-N-propylpyrrolidin-3-amine
CID 104973725
N-(3-methylcyclohexyl)-N-propylpyrrolidin-3-amine
CID 63300868
N-(4-methylcyclohexyl)-N-propylpyrrolidin-3-amine
CID 63300696
N-(3,5-dimethylcyclohexyl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 64752902
N-(5-methylthiolan-3-yl)-N-propylpiperidin-3-amine
CID 79950974
N-(4-methylcycloheptyl)-N-propylazetidin-3-amine
CID 66182876
N-ethyl-N-(3,3,5-trimethylcyclohexyl)pyrrolidin-3-amine
CID 63299103
3,5-dimethyl-N-(piperidin-3-ylmethyl)-N-propylcyclohexan-1-amine
CID 106625170
N-cyclohexyl-N-propylazetidin-3-amine
CID 66183284
N-propyl-N-pyrrolidin-3-ylethanesulfonamide
CID 60805146
N-(2,6-dimethylcyclohexyl)-N-ethylpyrrolidin-3-amine
CID 63299544
N-(2,3-dihydro-1H-inden-1-yl)-N-propylpyrrolidin-3-amine
CID 55203622

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine?
The IUPAC name of N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine (CID 64751703) is N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine.
What is the SMILES notation for N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine?
The canonical SMILES for N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine is CCCN(C1CCNC1)C1CC(C)CC(C)C1.
What is the InChIKey of N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine?
The InChIKey is LHKPNBLOLKOJDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-7-17(14-5-6-16-11-14)15-9-12(2)8-13(3)10-15/h12-16H,4-11H2,1-3H3.
What are the key properties of N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine?
N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine has a molecular weight of 238.42 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylcyclohexyl)-N-propylpyrrolidin-3-amine is sourced from PubChem (CID 64751703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).