[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol

C17H34N2O — CID 79866549

IUPAC[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol
SMILESCCCNC1C(CN2CCC(CO)CC2)CCC1(C)C
InChIInChI=1S/C17H34N2O/c1-4-9-18-16-15(5-8-17(16,2)3)12-19-10-6-14(13-20)7-11-19/h14-16,18,20H,4-13H2,1-3H3
InChIKeyZBCPXCYGZLPINQ-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.50
Rot. Bonds6

About [1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol

[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol (PubChem CID 79866549) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is [1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol
PubChem CID79866549
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol
SMILESCCCNC1C(CN2CCC(CO)CC2)CCC1(C)C
InChIInChI=1S/C17H34N2O/c1-4-9-18-16-15(5-8-17(16,2)3)12-19-10-6-14(13-20)7-11-19/h14-16,18,20H,4-13H2,1-3H3
InChIKeyZBCPXCYGZLPINQ-UHFFFAOYSA-N
XLogP2.50
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol with MolForge

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Related Compounds

2,2-dimethyl-5-[(4-methylpiperazin-1-yl)methyl]-N-propylcyclopentan-1-amine
CID 79865591
2,2-dimethyl-5-(morpholin-4-ylmethyl)-N-propylcyclopentan-1-amine
CID 79866931
1-[[3,3-dimethyl-2-(propylamino)cyclohexyl]methyl]piperidin-4-ol
CID 79852206
5-[(3,4-dimethoxypyrrolidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 103539183
2,2-dimethyl-N-propyl-5-(1,4-thiazepan-4-ylmethyl)cyclopentan-1-amine
CID 79855942
6-[(4-ethylpiperazin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79842409
1-[[3,3-dimethyl-2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-ol
CID 79848410
N,2,2-trimethyl-5-[(4-propylpiperidin-1-yl)methyl]cyclopentan-1-amine
CID 79865903
2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol
CID 79866086
1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol
CID 106837898
N-ethyl-5-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-2,2-dimethylcyclopentan-1-amine
CID 79855421
5-[(2,5-dimethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79855959

Frequently Asked Questions

What is the IUPAC name of [1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol?
The IUPAC name of [1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol (CID 79866549) is [1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol.
What is the SMILES notation for [1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol?
The canonical SMILES for [1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol is CCCNC1C(CN2CCC(CO)CC2)CCC1(C)C.
What is the InChIKey of [1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol?
The InChIKey is ZBCPXCYGZLPINQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-4-9-18-16-15(5-8-17(16,2)3)12-19-10-6-14(13-20)7-11-19/h14-16,18,20H,4-13H2,1-3H3.
What are the key properties of [1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol?
[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol has a molecular weight of 282.47 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol is sourced from PubChem (CID 79866549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).