2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol

C18H36N2O — CID 79866086

IUPAC2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol
SMILESCCCNC1C(CN2CCCCC2CCO)CCC1(C)C
InChIInChI=1S/C18H36N2O/c1-4-11-19-17-15(8-10-18(17,2)3)14-20-12-6-5-7-16(20)9-13-21/h15-17,19,21H,4-14H2,1-3H3
InChIKeyJARVXAOWGYIGLX-UHFFFAOYSA-N
MW296.50 g/mol
LogP3.03
Rot. Bonds7

About 2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol

2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol (PubChem CID 79866086) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is 2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol
PubChem CID79866086
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC Name2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol
SMILESCCCNC1C(CN2CCCCC2CCO)CCC1(C)C
InChIInChI=1S/C18H36N2O/c1-4-11-19-17-15(8-10-18(17,2)3)14-20-12-6-5-7-16(20)9-13-21/h15-17,19,21H,4-14H2,1-3H3
InChIKeyJARVXAOWGYIGLX-UHFFFAOYSA-N
XLogP3.03
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79842434
N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine
CID 79865475
[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol
CID 79866549
5-[(2,5-dimethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79855959
6-[(2,3-dimethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79842625
2,2-dimethyl-5-[(4-methylpiperazin-1-yl)methyl]-N-propylcyclopentan-1-amine
CID 79865591
2-[1-[2-(propylamino)ethyl]piperidin-2-yl]ethanol
CID 53211565
2,2-dimethyl-5-(morpholin-4-ylmethyl)-N-propylcyclopentan-1-amine
CID 79866931
2-[(2S)-1-ethylpiperidin-2-yl]ethanol
CID 26365884
2-[1-[[1-(propylaminomethyl)cyclopentyl]methyl]piperidin-2-yl]ethanol
CID 62261936
2-[1-[[2-(methylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol
CID 62615546
2-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl-propylamino]ethanol
CID 79867198

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol (CID 79866086) is 2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol is CCCNC1C(CN2CCCCC2CCO)CCC1(C)C.
What is the InChIKey of 2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol?
The InChIKey is JARVXAOWGYIGLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-4-11-19-17-15(8-10-18(17,2)3)14-20-12-6-5-7-16(20)9-13-21/h15-17,19,21H,4-14H2,1-3H3.
What are the key properties of 2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol?
2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol has a molecular weight of 296.50 g/mol, XLogP of 3.03, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 79866086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).