1-benzyl-3-hydroxypiperidine-4-carboxamide

C13H18N2O2 — CID 146447166

IUPAC1-benzyl-3-hydroxypiperidine-4-carboxamide
SMILESNC(=O)C1CCN(Cc2ccccc2)CC1O
InChIInChI=1S/C13H18N2O2/c14-13(17)11-6-7-15(9-12(11)16)8-10-4-2-1-3-5-10/h1-5,11-12,16H,6-9H2,(H2,14,17)
InChIKeyOUFRRCCGJZJWGN-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.35
Rot. Bonds3

About 1-benzyl-3-hydroxypiperidine-4-carboxamide

1-benzyl-3-hydroxypiperidine-4-carboxamide (PubChem CID 146447166) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 1-benzyl-3-hydroxypiperidine-4-carboxamide.

Molecular Properties

Compound Name1-benzyl-3-hydroxypiperidine-4-carboxamide
PubChem CID146447166
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name1-benzyl-3-hydroxypiperidine-4-carboxamide
SMILESNC(=O)C1CCN(Cc2ccccc2)CC1O
InChIInChI=1S/C13H18N2O2/c14-13(17)11-6-7-15(9-12(11)16)8-10-4-2-1-3-5-10/h1-5,11-12,16H,6-9H2,(H2,14,17)
InChIKeyOUFRRCCGJZJWGN-UHFFFAOYSA-N
XLogP0.35
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R,4R)-1-benzyl-4-hydroxypiperidine-3-carboxylic acid
CID 70556270
(3S,4R)-4-amino-1-benzylpiperidin-3-ol;hydrochloride
CID 67227523
1-benzyl-5-hydroxyazepane-4-carboxylic acid
CID 83488362
(3R,4R)-4-amino-1-benzylpiperidin-3-ol;dihydrochloride
CID 163338239
1-benzyl-4-(iodomethyl)piperidin-3-ol
CID 71649873
1-benzyl-3-phenylpiperidine-4-carboxylic acid
CID 3345807
sodium (3S,4R)-1-benzyl-4-hydroxypiperidine-3-carboxylate
CID 68688042
(3R,4R)-1-benzyl-4-phenylpiperidin-3-ol
CID 54282589
ethyl 1-benzyl-3-ethylpiperidine-4-carboxylate
CID 146401947
methyl (3S,4S)-1-benzyl-4-hydroxypiperidine-3-carboxylate
CID 54043157
methyl (3R,4S)-1-benzyl-4-hydroxypiperidine-3-carboxylate
CID 86328839
(3R,4S)-1-benzyl-4-(hydroxymethyl)piperidin-3-ol
CID 15450831

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-hydroxypiperidine-4-carboxamide?
The IUPAC name of 1-benzyl-3-hydroxypiperidine-4-carboxamide (CID 146447166) is 1-benzyl-3-hydroxypiperidine-4-carboxamide.
What is the SMILES notation for 1-benzyl-3-hydroxypiperidine-4-carboxamide?
The canonical SMILES for 1-benzyl-3-hydroxypiperidine-4-carboxamide is NC(=O)C1CCN(Cc2ccccc2)CC1O.
What is the InChIKey of 1-benzyl-3-hydroxypiperidine-4-carboxamide?
The InChIKey is OUFRRCCGJZJWGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c14-13(17)11-6-7-15(9-12(11)16)8-10-4-2-1-3-5-10/h1-5,11-12,16H,6-9H2,(H2,14,17).
What are the key properties of 1-benzyl-3-hydroxypiperidine-4-carboxamide?
1-benzyl-3-hydroxypiperidine-4-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-hydroxypiperidine-4-carboxamide is sourced from PubChem (CID 146447166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).