3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide

C13H18N2O3 — CID 110933496

IUPAC3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide
SMILESO=C(NOCc1ccccc1)N1CCCC(O)C1
InChIInChI=1S/C13H18N2O3/c16-12-7-4-8-15(9-12)13(17)14-18-10-11-5-2-1-3-6-11/h1-3,5-6,12,16H,4,7-10H2,(H,14,17)
InChIKeyJVMBPIJNDLBCCY-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.28
Rot. Bonds3

About 3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide

3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide (PubChem CID 110933496) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide
PubChem CID110933496
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide
SMILESO=C(NOCc1ccccc1)N1CCCC(O)C1
InChIInChI=1S/C13H18N2O3/c16-12-7-4-8-15(9-12)13(17)14-18-10-11-5-2-1-3-6-11/h1-3,5-6,12,16H,4,7-10H2,(H,14,17)
InChIKeyJVMBPIJNDLBCCY-UHFFFAOYSA-N
XLogP1.28
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-phenylmethoxyazepane-1-carboxamide
CID 112689523
1-(3-hydroxypiperidin-1-yl)-2-phenylmethoxypropan-1-one
CID 43428067
(3S)-1-N-phenyl-3-N-phenylmethoxypiperidine-1,3-dicarboxamide
CID 32578740
benzyl N-[(3S)-3-hydroxy-4-[(3R)-3-hydroxypiperidin-1-yl]-4-oxobutyl]carbamate
CID 166391197
2-(4-hydroxypiperidin-1-yl)-N-phenylmethoxyacetamide
CID 110881841
benzyl (3R)-4-amino-3-hydroxyazepane-1-carboxylate
CID 67555799
benzyl (3R,4R)-4-fluoro-3-hydroxyazepane-1-carboxylate
CID 118230294
4-(1H-indol-2-yl)-N-phenylmethoxypiperidine-1-carboxamide
CID 95164710
1-(furan-2-carbonyl)-N-phenylmethoxypiperidine-3-carboxamide
CID 47019403
(2R)-2-(2-methylphenyl)-N-phenylmethoxypyrrolidine-1-carboxamide
CID 94867549
3-hydroxy-N-[3-(methoxymethyl)phenyl]piperidine-1-carboxamide
CID 51080395
2-cyclobutyl-N-phenylmethoxyacetamide
CID 103706482

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide?
The IUPAC name of 3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide (CID 110933496) is 3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide.
What is the SMILES notation for 3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide?
The canonical SMILES for 3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide is O=C(NOCc1ccccc1)N1CCCC(O)C1.
What is the InChIKey of 3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide?
The InChIKey is JVMBPIJNDLBCCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c16-12-7-4-8-15(9-12)13(17)14-18-10-11-5-2-1-3-6-11/h1-3,5-6,12,16H,4,7-10H2,(H,14,17).
What are the key properties of 3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide?
3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 1.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-phenylmethoxypiperidine-1-carboxamide is sourced from PubChem (CID 110933496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).