3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide

C13H18N2O2 — CID 84726978

IUPAC3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide
SMILESCc1cccc(NC(=O)C2(O)CCCNC2)c1
InChIInChI=1S/C13H18N2O2/c1-10-4-2-5-11(8-10)15-12(16)13(17)6-3-7-14-9-13/h2,4-5,8,14,17H,3,6-7,9H2,1H3,(H,15,16)
InChIKeyRZNZYAZTLATPHF-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.05
Rot. Bonds2

About 3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide

3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide (PubChem CID 84726978) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide
PubChem CID84726978
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide
SMILESCc1cccc(NC(=O)C2(O)CCCNC2)c1
InChIInChI=1S/C13H18N2O2/c1-10-4-2-5-11(8-10)15-12(16)13(17)6-3-7-14-9-13/h2,4-5,8,14,17H,3,6-7,9H2,1H3,(H,15,16)
InChIKeyRZNZYAZTLATPHF-UHFFFAOYSA-N
XLogP1.05
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide?
The IUPAC name of 3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide (CID 84726978) is 3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide?
The canonical SMILES for 3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide is Cc1cccc(NC(=O)C2(O)CCCNC2)c1.
What is the InChIKey of 3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide?
The InChIKey is RZNZYAZTLATPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-10-4-2-5-11(8-10)15-12(16)13(17)6-3-7-14-9-13/h2,4-5,8,14,17H,3,6-7,9H2,1H3,(H,15,16).
What are the key properties of 3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide?
3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 1.05, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(3-methylphenyl)piperidine-3-carboxamide is sourced from PubChem (CID 84726978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).