1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide

C14H18N2O3 — CID 43228109

IUPAC1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(CC(=O)c2ccc(O)cc2)CC1
InChIInChI=1S/C14H18N2O3/c15-14(19)11-5-7-16(8-6-11)9-13(18)10-1-3-12(17)4-2-10/h1-4,11,17H,5-9H2,(H2,15,19)
InChIKeyMHSYDFWSWLOPPR-UHFFFAOYSA-N
MW262.31 g/mol
LogP0.77
Rot. Bonds4

About 1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide

1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide (PubChem CID 43228109) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide
PubChem CID43228109
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(CC(=O)c2ccc(O)cc2)CC1
InChIInChI=1S/C14H18N2O3/c15-14(19)11-5-7-16(8-6-11)9-13(18)10-1-3-12(17)4-2-10/h1-4,11,17H,5-9H2,(H2,15,19)
InChIKeyMHSYDFWSWLOPPR-UHFFFAOYSA-N
XLogP0.77
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-cyanophenyl)-2-oxoethyl]piperidine-4-carboxamide
CID 43228110
1-(4-hydroxyphenyl)-2-(4-hydroxypiperidin-1-yl)ethanone
CID 60680512
1-[2-(2,4-dihydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide
CID 43219698
1-[2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]piperidine-4-carboxamide
CID 82104485
2-[4-(2-hydroxyethyl)piperazin-1-yl]-1-(4-hydroxyphenyl)ethanone
CID 60680749
1-[2-(3,4-dihydro-2H-1,4-benzoxazin-6-yl)-2-oxoethyl]piperidine-4-carboxamide
CID 82261221
1-[2-(3,4-dihydroxy-5-nitrophenyl)-2-oxoethyl]piperidine-4-carboxamide;hydrochloride
CID 70031509
1-(4-hydroxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone
CID 43228420
[1-[2-(4-fluorophenyl)-2-oxoethyl]piperidin-4-yl]methyl carbamate
CID 175555428
4-[2-(4-hydroxyphenyl)-2-oxoethyl]morpholine-3-carboxamide
CID 83095436
2-(3,4-dimethylpiperazin-1-yl)-1-(4-hydroxyphenyl)ethanone
CID 63608714
1-(2-hydrazinyl-2-oxoethyl)piperidine-4-carboxamide
CID 63568809

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide?
The IUPAC name of 1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide (CID 43228109) is 1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide is NC(=O)C1CCN(CC(=O)c2ccc(O)cc2)CC1.
What is the InChIKey of 1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide?
The InChIKey is MHSYDFWSWLOPPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c15-14(19)11-5-7-16(8-6-11)9-13(18)10-1-3-12(17)4-2-10/h1-4,11,17H,5-9H2,(H2,15,19).
What are the key properties of 1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide?
1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 0.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-hydroxyphenyl)-2-oxoethyl]piperidine-4-carboxamide is sourced from PubChem (CID 43228109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).