(2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone

C13H23NO2 — CID 104917952

IUPAC(2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone
SMILESCC1(C)CCCC1C(=O)N1CCC(O)CC1
InChIInChI=1S/C13H23NO2/c1-13(2)7-3-4-11(13)12(16)14-8-5-10(15)6-9-14/h10-11,15H,3-9H2,1-2H3
InChIKeyCAWIEKNJGMSQQW-UHFFFAOYSA-N
MW225.33 g/mol
LogP1.80
Rot. Bonds1

About (2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone

(2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone (PubChem CID 104917952) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is (2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name(2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone
PubChem CID104917952
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name(2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone
SMILESCC1(C)CCCC1C(=O)N1CCC(O)CC1
InChIInChI=1S/C13H23NO2/c1-13(2)7-3-4-11(13)12(16)14-8-5-10(15)6-9-14/h10-11,15H,3-9H2,1-2H3
InChIKeyCAWIEKNJGMSQQW-UHFFFAOYSA-N
XLogP1.80
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-bromopiperidin-1-yl)-(2,2-dimethylcyclopentyl)methanone
CID 107183919
[4-(chloromethyl)piperidin-1-yl]-(2,2-dimethylcyclohexyl)methanone
CID 107183885
(2,2-dimethylcyclopentyl)-(3-hydroxy-3-methylpyrrolidin-1-yl)methanone
CID 104919981
[4-(bromomethyl)piperidin-1-yl]-(2,2-dimethylcyclohexyl)methanone
CID 107183985
2-[1-(2,2-dimethylcyclohexanecarbonyl)piperidin-4-yl]acetic acid
CID 107175719
[3-(aminomethyl)pyrrolidin-1-yl]-(2,2-dimethylcyclopentyl)methanone
CID 107180661
[4-(1-aminoethyl)piperidin-1-yl]-(2,2-dimethylcyclohexyl)methanone
CID 107180739
2-[4-(2,2-dimethylcyclopentanecarbonyl)-1,4-diazepan-1-yl]acetic acid
CID 107175413
[4-(1-amino-2-methylpropan-2-yl)piperazin-1-yl]-(2,2-dimethylcyclopentyl)methanone
CID 107174639
[4-(2-chloroethoxy)piperidin-1-yl]-(2,2-dimethylcyclohexyl)methanone
CID 107184260
[4-(2-chloroethyl)-1,4-diazepan-1-yl]-(2,2-dimethylcyclopentyl)methanone
CID 107183870
[4-(cyclopropylmethylamino)piperidin-1-yl]-(2,2-dimethylcyclohexyl)methanone
CID 107181008

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone?
The IUPAC name of (2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone (CID 104917952) is (2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone.
What is the SMILES notation for (2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone?
The canonical SMILES for (2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone is CC1(C)CCCC1C(=O)N1CCC(O)CC1.
What is the InChIKey of (2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone?
The InChIKey is CAWIEKNJGMSQQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-13(2)7-3-4-11(13)12(16)14-8-5-10(15)6-9-14/h10-11,15H,3-9H2,1-2H3.
What are the key properties of (2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone?
(2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone has a molecular weight of 225.33 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethylcyclopentyl)-(4-hydroxypiperidin-1-yl)methanone is sourced from PubChem (CID 104917952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).