[2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol

C18H36N2O — CID 79573438

IUPAC[2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
SMILESCCC1(CC)CCN(CCC2CCCC2(CO)NC)CC1
InChIInChI=1S/C18H36N2O/c1-4-17(5-2)10-13-20(14-11-17)12-8-16-7-6-9-18(16,15-21)19-3/h16,19,21H,4-15H2,1-3H3
InChIKeyYHACGMUBSURUNK-UHFFFAOYSA-N
MW296.50 g/mol
LogP3.03
Rot. Bonds7

About [2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol

[2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol (PubChem CID 79573438) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is [2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
PubChem CID79573438
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC Name[2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
SMILESCCC1(CC)CCN(CCC2CCCC2(CO)NC)CC1
InChIInChI=1S/C18H36N2O/c1-4-17(5-2)10-13-20(14-11-17)12-8-16-7-6-9-18(16,15-21)19-3/h16,19,21H,4-15H2,1-3H3
InChIKeyYHACGMUBSURUNK-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

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Related Compounds

[2-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79571164
[2-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79570958
[2-[2-(4-tert-butylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79572951
[2-[2-[3-(dimethylamino)pyrrolidin-1-yl]ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79571423
[2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79571011
[2-[2-(3,4-dimethoxypyrrolidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 103540797
[2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571987
[1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol
CID 79571001
[2-[2-(4-methylpiperidin-1-yl)ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571574
[1-(methylamino)-2-(2-propoxyethyl)cyclopentyl]methanol
CID 79581094
[2-[2-(3-methylpyrrolidin-1-yl)ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571310
[2-[2-(3,5-diethylpyrazol-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 82700707

Frequently Asked Questions

What is the IUPAC name of [2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol?
The IUPAC name of [2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol (CID 79573438) is [2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol.
What is the SMILES notation for [2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol?
The canonical SMILES for [2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol is CCC1(CC)CCN(CCC2CCCC2(CO)NC)CC1.
What is the InChIKey of [2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol?
The InChIKey is YHACGMUBSURUNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-4-17(5-2)10-13-20(14-11-17)12-8-16-7-6-9-18(16,15-21)19-3/h16,19,21H,4-15H2,1-3H3.
What are the key properties of [2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol?
[2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol 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-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol is sourced from PubChem (CID 79573438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).