(4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone

C16H28N2O2 — CID 177011015

IUPAC(4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone
SMILESCC1CCN(C2CC(C(=O)N3CCC(O)CC3)C2)CC1
InChIInChI=1S/C16H28N2O2/c1-12-2-6-17(7-3-12)14-10-13(11-14)16(20)18-8-4-15(19)5-9-18/h12-15,19H,2-11H2,1H3
InChIKeySFSBWQYXKYQPHU-UHFFFAOYSA-N
MW280.41 g/mol
LogP1.48
Rot. Bonds2

About (4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone

(4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone (PubChem CID 177011015) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is (4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone.

Molecular Properties

Compound Name(4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone
PubChem CID177011015
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name(4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone
SMILESCC1CCN(C2CC(C(=O)N3CCC(O)CC3)C2)CC1
InChIInChI=1S/C16H28N2O2/c1-12-2-6-17(7-3-12)14-10-13(11-14)16(20)18-8-4-15(19)5-9-18/h12-15,19H,2-11H2,1H3
InChIKeySFSBWQYXKYQPHU-UHFFFAOYSA-N
XLogP1.48
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[2-(3-Fluoro-4-hydroxypiperidin-1-yl)ethyl]piperidin-1-yl]-2-methylpropan-1-one
CID 171550650
[4-(4-Hydroxypiperidine-1-carbonyl)piperidin-1-yl]-methylborinic acid
CID 57983037
(4-Hydroxypiperidin-1-yl)-(1-methylpiperidin-4-yl)methanone
CID 84458625
Ethane;[4-(2-hydroxyethyl)piperidin-1-yl]-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone
CID 153349821
1-[4-[(4-Hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]-3,3-dimethylbutan-1-one
CID 155721017
Cyclopropyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone
CID 155721055
Cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone
CID 155721081
1-[4-[(4-Hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]butan-1-one
CID 155721096
1-[4-[(4-Hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 155721126
Cyclobutyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone
CID 155721174
1-(4-Hydroxypiperidin-1-yl)-2-methyl-5-(4-propan-2-ylpiperidin-1-yl)pentane-1,5-dione
CID 156323168
1-[4-[(4-Hydroxypiperidin-1-yl)methyl]piperidin-1-yl]butan-1-one
CID 157039274

Frequently Asked Questions

What is the IUPAC name of (4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone?
The IUPAC name of (4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone (CID 177011015) is (4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone.
What is the SMILES notation for (4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone?
The canonical SMILES for (4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone is CC1CCN(C2CC(C(=O)N3CCC(O)CC3)C2)CC1.
What is the InChIKey of (4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone?
The InChIKey is SFSBWQYXKYQPHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-12-2-6-17(7-3-12)14-10-13(11-14)16(20)18-8-4-15(19)5-9-18/h12-15,19H,2-11H2,1H3.
What are the key properties of (4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone?
(4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone has a molecular weight of 280.41 g/mol, XLogP of 1.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxypiperidin-1-yl)-[3-(4-methylpiperidin-1-yl)cyclobutyl]methanone is sourced from PubChem (CID 177011015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).