1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide

C14H18N2O3 — CID 43176610

IUPAC1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide
SMILESCc1ccc(C(=O)N2CCCC(C(N)=O)C2)c(O)c1
InChIInChI=1S/C14H18N2O3/c1-9-4-5-11(12(17)7-9)14(19)16-6-2-3-10(8-16)13(15)18/h4-5,7,10,17H,2-3,6,8H2,1H3,(H2,15,18)
InChIKeyYPZRFCRWZPGDQL-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.04
Rot. Bonds2

About 1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide

1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide (PubChem CID 43176610) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide
PubChem CID43176610
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide
SMILESCc1ccc(C(=O)N2CCCC(C(N)=O)C2)c(O)c1
InChIInChI=1S/C14H18N2O3/c1-9-4-5-11(12(17)7-9)14(19)16-6-2-3-10(8-16)13(15)18/h4-5,7,10,17H,2-3,6,8H2,1H3,(H2,15,18)
InChIKeyYPZRFCRWZPGDQL-UHFFFAOYSA-N
XLogP1.04
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3,4-dimethoxyphenyl)-[(3S)-1-(2-hydroxy-4-methylbenzoyl)piperidin-3-yl]methanone
CID 95711372
[3-(dimethylamino)piperidin-1-yl]-(2-hydroxy-4-methylphenyl)methanone
CID 63091098
(3-ethoxypiperidin-1-yl)-(2-hydroxy-4-methylphenyl)methanone
CID 54983413
1-(2-amino-5-methylbenzoyl)pyrrolidine-3-carboxamide
CID 114081662
1-(2-amino-4-bromobenzoyl)piperidine-3-carboxamide
CID 79714737
ethyl (3R)-1-(2,4-dimethylbenzoyl)piperidine-3-carboxylate
CID 81338523
1-(4-hydroxy-2-methylbenzoyl)pyrrolidine-3-carboxamide
CID 103865451
1-(4-fluoro-2-iodobenzoyl)piperidine-3-carboxamide
CID 103617048
1-(2-bromo-5-methylbenzoyl)-N'-hydroxypiperidine-3-carboximidamide
CID 81117704
(3,4-dimethylpyrrolidin-1-yl)-(2-hydroxy-4-methylphenyl)methanone
CID 79039969
1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide
CID 103891600
ethyl 1-(2-fluoro-4-methylbenzoyl)piperidine-3-carboxylate
CID 79765192

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide?
The IUPAC name of 1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide (CID 43176610) is 1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide is Cc1ccc(C(=O)N2CCCC(C(N)=O)C2)c(O)c1.
What is the InChIKey of 1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide?
The InChIKey is YPZRFCRWZPGDQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-9-4-5-11(12(17)7-9)14(19)16-6-2-3-10(8-16)13(15)18/h4-5,7,10,17H,2-3,6,8H2,1H3,(H2,15,18).
What are the key properties of 1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide?
1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 1.04, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxy-4-methylbenzoyl)piperidine-3-carboxamide is sourced from PubChem (CID 43176610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).