3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide

C17H26N2O2 — CID 111496368

IUPAC3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide
SMILESCc1ccccc1NC(=O)CCN1CCCCC1C(C)O
InChIInChI=1S/C17H26N2O2/c1-13-7-3-4-8-15(13)18-17(21)10-12-19-11-6-5-9-16(19)14(2)20/h3-4,7-8,14,16,20H,5-6,9-12H2,1-2H3,(H,18,21)
InChIKeyPQSNOCODTCEOTG-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.56
Rot. Bonds5

About 3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide

3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide (PubChem CID 111496368) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide.

Molecular Properties

Compound Name3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide
PubChem CID111496368
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide
SMILESCc1ccccc1NC(=O)CCN1CCCCC1C(C)O
InChIInChI=1S/C17H26N2O2/c1-13-7-3-4-8-15(13)18-17(21)10-12-19-11-6-5-9-16(19)14(2)20/h3-4,7-8,14,16,20H,5-6,9-12H2,1-2H3,(H,18,21)
InChIKeyPQSNOCODTCEOTG-UHFFFAOYSA-N
XLogP2.56
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-dichlorophenyl)-3-[2-(1-hydroxyethyl)piperidin-1-yl]propanamide
CID 111107084
3-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide
CID 111476136
N-(2-methylphenyl)-3-pyrrolidin-1-ylpropanamide;hydrochloride
CID 2902883
N-(2,5-dimethylphenyl)-2-[2-(1-hydroxyethyl)piperidin-1-yl]acetamide
CID 111107012
N-ethyl-3-[2-(1-hydroxyethyl)piperidin-1-yl]propanamide
CID 111107076
3-[2-(1-aminoethyl)piperidin-1-yl]-N-phenylpropanamide;hydrochloride
CID 119911160
N-(2-methylphenyl)-2-[(2S)-2-methylpiperidin-1-yl]acetamide
CID 7332900
3-[(2S)-2-[(1R)-1-hydroxypropyl]piperidin-1-yl]-N-(2-methyl-3-nitrophenyl)propanamide
CID 95331656
2-(2-ethylpiperidin-1-yl)-N-(2-methylphenyl)acetamide
CID 78787228
N-(2-chlorophenyl)-3-(2-formylpiperidin-1-yl)propanamide
CID 62654443
N-(2-aminophenyl)-3-(2-methylpiperidin-1-yl)propanamide
CID 16779613
4-hydroxy-N-(2-methylphenyl)pentanamide
CID 79017195

Frequently Asked Questions

What is the IUPAC name of 3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide?
The IUPAC name of 3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide (CID 111496368) is 3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide.
What is the SMILES notation for 3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide?
The canonical SMILES for 3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide is Cc1ccccc1NC(=O)CCN1CCCCC1C(C)O.
What is the InChIKey of 3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide?
The InChIKey is PQSNOCODTCEOTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13-7-3-4-8-15(13)18-17(21)10-12-19-11-6-5-9-16(19)14(2)20/h3-4,7-8,14,16,20H,5-6,9-12H2,1-2H3,(H,18,21).
What are the key properties of 3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide?
3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide has a molecular weight of 290.41 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide is sourced from PubChem (CID 111496368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).