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

C14H28N2O — CID 79867046

IUPAC1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol
SMILESCNC1C(CN2CCC(O)CC2)CCC1(C)C
InChIInChI=1S/C14H28N2O/c1-14(2)7-4-11(13(14)15-3)10-16-8-5-12(17)6-9-16/h11-13,15,17H,4-10H2,1-3H3
InChIKeyKWNMWPXDBDHHEJ-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.47
Rot. Bonds3

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

1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol (PubChem CID 79867046) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol
PubChem CID79867046
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol
SMILESCNC1C(CN2CCC(O)CC2)CCC1(C)C
InChIInChI=1S/C14H28N2O/c1-14(2)7-4-11(13(14)15-3)10-16-8-5-12(17)6-9-16/h11-13,15,17H,4-10H2,1-3H3
InChIKeyKWNMWPXDBDHHEJ-UHFFFAOYSA-N
XLogP1.47
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-yl]ethanol
CID 106837898
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-[[3,3-dimethyl-2-(propylamino)cyclohexyl]methyl]piperidin-4-ol
CID 79852206
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
[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-4-yl]methanol
CID 79866549

Frequently Asked Questions

What is the IUPAC name of 1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol?
The IUPAC name of 1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol (CID 79867046) is 1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol.
What is the SMILES notation for 1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol?
The canonical SMILES for 1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol is CNC1C(CN2CCC(O)CC2)CCC1(C)C.
What is the InChIKey of 1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol?
The InChIKey is KWNMWPXDBDHHEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-14(2)7-4-11(13(14)15-3)10-16-8-5-12(17)6-9-16/h11-13,15,17H,4-10H2,1-3H3.
What are the key properties of 1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol?
1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]piperidin-4-ol has a molecular weight of 240.39 g/mol, XLogP of 1.47, 3 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-(methylamino)cyclopentyl]methyl]piperidin-4-ol is sourced from PubChem (CID 79867046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).