2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine

C15H30N2 — CID 79187934

IUPAC2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine
SMILESCCCNC1CCCCC1N1CC(C)C(C)C1
InChIInChI=1S/C15H30N2/c1-4-9-16-14-7-5-6-8-15(14)17-10-12(2)13(3)11-17/h12-16H,4-11H2,1-3H3
InChIKeyMIKFJQBFKMNOGX-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.88
Rot. Bonds4

About 2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine

2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine (PubChem CID 79187934) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine
PubChem CID79187934
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine
SMILESCCCNC1CCCCC1N1CC(C)C(C)C1
InChIInChI=1S/C15H30N2/c1-4-9-16-14-7-5-6-8-15(14)17-10-12(2)13(3)11-17/h12-16H,4-11H2,1-3H3
InChIKeyMIKFJQBFKMNOGX-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

2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclooctan-1-amine
CID 79188224
2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcycloheptan-1-amine
CID 79188611
N,N,4-trimethyl-1-[2-(propylamino)cycloheptyl]pyrrolidin-3-amine
CID 81465092
N-propyl-2-(3,4,5-trimethylpiperazin-1-yl)cyclohexan-1-amine
CID 114537740
2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclopentan-1-amine
CID 66394027
2-(3-methoxy-4-methylpiperidin-1-yl)-N-propylcyclooctan-1-amine
CID 102965411
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-propylcyclohexan-1-amine
CID 79938748
2-(4-propan-2-ylpiperidin-1-yl)-N-propylcyclooctan-1-amine
CID 103494992
2-[3-(methoxymethyl)piperidin-1-yl]-N-propylcyclooctan-1-amine
CID 106586680
1-cyclohexyl-3-methyl-N-propylpiperidin-4-amine
CID 54975332
2-[4-(methoxymethyl)piperidin-1-yl]-N-propylcycloheptan-1-amine
CID 63972305
2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine
CID 79174695

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine?
The IUPAC name of 2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine (CID 79187934) is 2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine.
What is the SMILES notation for 2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine?
The canonical SMILES for 2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine is CCCNC1CCCCC1N1CC(C)C(C)C1.
What is the InChIKey of 2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine?
The InChIKey is MIKFJQBFKMNOGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-9-16-14-7-5-6-8-15(14)17-10-12(2)13(3)11-17/h12-16H,4-11H2,1-3H3.
What are the key properties of 2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine?
2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-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 2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine is sourced from PubChem (CID 79187934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).