1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one

C17H22N2O3 — CID 110882060

IUPAC1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one
SMILESO=C(c1ccc(N2CCCCC2=O)cc1)N1CCC(O)CC1
InChIInChI=1S/C17H22N2O3/c20-15-8-11-18(12-9-15)17(22)13-4-6-14(7-5-13)19-10-2-1-3-16(19)21/h4-7,15,20H,1-3,8-12H2
InChIKeyCXAGNXKDVZANRT-UHFFFAOYSA-N
MW302.37 g/mol
LogP1.80
Rot. Bonds2

About 1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one

1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one (PubChem CID 110882060) has the molecular formula C17H22N2O3 and a molecular weight of 302.37 g/mol. Its IUPAC name is 1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one.

Molecular Properties

Compound Name1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one
PubChem CID110882060
Molecular FormulaC17H22N2O3
Molecular Weight302.37 g/mol
Exact Mass302.16
IUPAC Name1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one
SMILESO=C(c1ccc(N2CCCCC2=O)cc1)N1CCC(O)CC1
InChIInChI=1S/C17H22N2O3/c20-15-8-11-18(12-9-15)17(22)13-4-6-14(7-5-13)19-10-2-1-3-16(19)21/h4-7,15,20H,1-3,8-12H2
InChIKeyCXAGNXKDVZANRT-UHFFFAOYSA-N
XLogP1.80
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(2-oxopiperidin-1-yl)benzoyl]piperidine-4-carboxamide
CID 32978699
1-[4-[4-(piperidine-1-carbonyl)piperazine-1-carbonyl]phenyl]pyrrolidin-2-one
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1-[4-[4-(morpholine-4-carbonyl)piperidine-1-carbonyl]phenyl]pyrrolidin-2-one
CID 46564409
1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one
CID 55748028
1-[4-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carbonyl]phenyl]pyrrolidin-2-one
CID 9296296
1-[4-[4-(2,2-dimethylpropanoyl)piperazine-1-carbonyl]phenyl]pyrrolidin-2-one
CID 134021429
1-[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]pyrrolidin-2-one
CID 7446641
4-[4-(2-oxopiperidin-1-yl)benzoyl]morpholine-2-carboxylic acid
CID 126793187
N-cyclopropyl-4-(2-oxopiperidin-1-yl)benzamide
CID 18105948
4-hydroxy-1-[4-(2-oxopyrrolidin-1-yl)benzoyl]piperidine-4-carboxylic acid
CID 119250901
1-[4-[4-(4-chlorophenyl)piperazine-1-carbonyl]phenyl]pyrrolidin-2-one
CID 3680379
1-[4-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazine-1-carbonyl]phenyl]pyrrolidin-2-one
CID 27744247

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one?
The IUPAC name of 1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one (CID 110882060) is 1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one.
What is the SMILES notation for 1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one?
The canonical SMILES for 1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one is O=C(c1ccc(N2CCCCC2=O)cc1)N1CCC(O)CC1.
What is the InChIKey of 1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one?
The InChIKey is CXAGNXKDVZANRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O3/c20-15-8-11-18(12-9-15)17(22)13-4-6-14(7-5-13)19-10-2-1-3-16(19)21/h4-7,15,20H,1-3,8-12H2.
What are the key properties of 1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one?
1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one has a molecular weight of 302.37 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one is sourced from PubChem (CID 110882060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).