2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide

C16H24N2O2 — CID 108898255

IUPAC2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide
SMILESCc1cccc(CNC(=O)N2CCCCC2CCO)c1
InChIInChI=1S/C16H24N2O2/c1-13-5-4-6-14(11-13)12-17-16(20)18-9-3-2-7-15(18)8-10-19/h4-6,11,15,19H,2-3,7-10,12H2,1H3,(H,17,20)
InChIKeyTVVXTNQWKVGZNC-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.44
Rot. Bonds4

About 2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide

2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide (PubChem CID 108898255) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide
PubChem CID108898255
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide
SMILESCc1cccc(CNC(=O)N2CCCCC2CCO)c1
InChIInChI=1S/C16H24N2O2/c1-13-5-4-6-14(11-13)12-17-16(20)18-9-3-2-7-15(18)8-10-19/h4-6,11,15,19H,2-3,7-10,12H2,1H3,(H,17,20)
InChIKeyTVVXTNQWKVGZNC-UHFFFAOYSA-N
XLogP2.44
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-fluorophenyl)methyl]-2-(2-hydroxyethyl)piperidine-1-carboxamide
CID 108898597
(2R)-N-[(3-methylphenyl)methyl]-2-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-1-carboxamide
CID 126449054
1-[(3-methylphenyl)methylcarbamoyl]piperidine-2-carboxylic acid
CID 61204446
(2R)-N-[[2-(dimethylamino)-4-methylphenyl]methyl]-2-(2-hydroxyethyl)piperidine-1-carboxamide
CID 99851395
(2S)-2-(2-hydroxyethyl)-N-[2-(4-methylphenyl)ethyl]piperidine-1-carboxamide
CID 124670162
2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide
CID 108901080
2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(3-methylphenyl)-2-oxoacetamide
CID 108515753
N-[(4-methylphenyl)methyl]-2-(2-pyrrolidin-1-ylethyl)piperidine-1-carboxamide
CID 56914375
(2R)-N-[(4-methylphenyl)methyl]-2-(2-pyrrolidin-1-ylethyl)piperidine-1-carboxamide
CID 95728102
N-[(3-methylphenyl)methyl]cyclopentanecarboxamide
CID 39985159
1-cyclohexyl-1-methyl-3-[(3-methylphenyl)methyl]urea
CID 108898085
2-(2-ethylpiperidine-1-carbonyl)-N-[(3-methylphenyl)methyl]cyclopropane-1-carboxamide
CID 109135337

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide?
The IUPAC name of 2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide (CID 108898255) is 2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide.
What is the SMILES notation for 2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide?
The canonical SMILES for 2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide is Cc1cccc(CNC(=O)N2CCCCC2CCO)c1.
What is the InChIKey of 2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide?
The InChIKey is TVVXTNQWKVGZNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-13-5-4-6-14(11-13)12-17-16(20)18-9-3-2-7-15(18)8-10-19/h4-6,11,15,19H,2-3,7-10,12H2,1H3,(H,17,20).
What are the key properties of 2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide?
2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide is sourced from PubChem (CID 108898255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).