1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol

C16H32N2O — CID 106837898

IUPAC1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol
SMILESCNC1C(CN2CCC(C(C)O)CC2)CCC1(C)C
InChIInChI=1S/C16H32N2O/c1-12(19)13-6-9-18(10-7-13)11-14-5-8-16(2,3)15(14)17-4/h12-15,17,19H,5-11H2,1-4H3
InChIKeyPKWWUUKLCJXUER-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.10
Rot. Bonds4

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

1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol (PubChem CID 106837898) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol.

Molecular Properties

Compound Name1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol
PubChem CID106837898
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol
SMILESCNC1C(CN2CCC(C(C)O)CC2)CCC1(C)C
InChIInChI=1S/C16H32N2O/c1-12(19)13-6-9-18(10-7-13)11-14-5-8-16(2,3)15(14)17-4/h12-15,17,19H,5-11H2,1-4H3
InChIKeyPKWWUUKLCJXUER-UHFFFAOYSA-N
XLogP2.10
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

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Related Compounds

1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol
CID 79867046
N,2,2-trimethyl-5-[(4-propylpiperidin-1-yl)methyl]cyclopentan-1-amine
CID 79865903
N,2,2-trimethyl-5-[(4-methyl-1,4-diazepan-1-yl)methyl]cyclopentan-1-amine
CID 79866831
N,2,2-trimethyl-5-[(4-methylsulfonylpiperazin-1-yl)methyl]cyclopentan-1-amine
CID 79855030
5-[(4-tert-butylazepan-1-yl)methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79866412
N,2,2-trimethyl-5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]cyclopentan-1-amine
CID 102745812
N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine
CID 79866936
1-[1-[[2,2,5,5-tetramethyl-4-(methylamino)oxolan-3-yl]methyl]pyrrolidin-3-yl]ethanol
CID 115967284
[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol
CID 79866549
5-[(2,6-dimethylmorpholin-4-yl)methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79866437
5-[(2,6-dimethylthiomorpholin-4-yl)methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79855724
[4-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 114780333

Frequently Asked Questions

What is the IUPAC name of 1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol?
The IUPAC name of 1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol (CID 106837898) is 1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol.
What is the SMILES notation for 1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol?
The canonical SMILES for 1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol is CNC1C(CN2CCC(C(C)O)CC2)CCC1(C)C.
What is the InChIKey of 1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol?
The InChIKey is PKWWUUKLCJXUER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-12(19)13-6-9-18(10-7-13)11-14-5-8-16(2,3)15(14)17-4/h12-15,17,19H,5-11H2,1-4H3.
What are the key properties of 1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol?
1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol has a molecular weight of 268.44 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol is sourced from PubChem (CID 106837898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).