N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine

C18H36N2 — CID 83052554

IUPACN-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine
SMILESCCCNC1CCCCCC1N1CCCCC1CCC
InChIInChI=1S/C18H36N2/c1-3-10-16-11-8-9-15-20(16)18-13-7-5-6-12-17(18)19-14-4-2/h16-19H,3-15H2,1-2H3
InChIKeyJEHGUGFLZPOTHB-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.34
Rot. Bonds6

About N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine

N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine (PubChem CID 83052554) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine.

Molecular Properties

Compound NameN-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine
PubChem CID83052554
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC NameN-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine
SMILESCCCNC1CCCCCC1N1CCCCC1CCC
InChIInChI=1S/C18H36N2/c1-3-10-16-11-8-9-15-20(16)18-13-7-5-6-12-17(18)19-14-4-2/h16-19H,3-15H2,1-2H3
InChIKeyJEHGUGFLZPOTHB-UHFFFAOYSA-N
XLogP4.34
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-propyl-2-(2-propylpiperidin-1-yl)cyclohexan-1-amine
CID 83053052
2-(2-ethylazepan-1-yl)-N-propylcyclohexan-1-amine
CID 104689600
2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-N-propylcycloheptan-1-amine
CID 63469924
2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-N-propylcyclohexan-1-amine
CID 65320976
2,2-dimethyl-N-propyl-6-(2-propylpiperidin-1-yl)cyclohexan-1-amine
CID 83053137
N-[[2-(2-propylpiperidin-1-yl)cyclobutyl]methyl]propan-1-amine
CID 83061780
2-(2-ethylazepan-1-yl)-N-methylcycloheptan-1-amine
CID 113441646
trans-(1R,2R)-2-(2-propylpiperidin-1-yl)cyclopentan-1-ol
CID 102734913
(2S)-1-cyclopentyl-2-propylpiperidine
CID 170635716
2-(4-propan-2-ylpiperidin-1-yl)-N-propylcyclooctan-1-amine
CID 103494992
2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcycloheptan-1-amine
CID 79188611
2-(3,4-dimethylpyrrolidin-1-yl)-N-propylcyclooctan-1-amine
CID 79188224

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine?
The IUPAC name of N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine (CID 83052554) is N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine.
What is the SMILES notation for N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine?
The canonical SMILES for N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine is CCCNC1CCCCCC1N1CCCCC1CCC.
What is the InChIKey of N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine?
The InChIKey is JEHGUGFLZPOTHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-3-10-16-11-8-9-15-20(16)18-13-7-5-6-12-17(18)19-14-4-2/h16-19H,3-15H2,1-2H3.
What are the key properties of N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine?
N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine has a molecular weight of 280.50 g/mol, XLogP of 4.34, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-(2-propylpiperidin-1-yl)cycloheptan-1-amine is sourced from PubChem (CID 83052554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).