2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide

C17H26N2O2 — CID 75810047

IUPAC2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide
SMILESCC(NC(=O)C(C)N1CCC(CO)CC1)c1ccccc1
InChIInChI=1S/C17H26N2O2/c1-13(16-6-4-3-5-7-16)18-17(21)14(2)19-10-8-15(12-20)9-11-19/h3-7,13-15,20H,8-12H2,1-2H3,(H,18,21)
InChIKeyOWFKCCVEAMGDKI-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.96
Rot. Bonds5

About 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide

2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide (PubChem CID 75810047) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide.

Molecular Properties

Compound Name2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide
PubChem CID75810047
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide
SMILESCC(NC(=O)C(C)N1CCC(CO)CC1)c1ccccc1
InChIInChI=1S/C17H26N2O2/c1-13(16-6-4-3-5-7-16)18-17(21)14(2)19-10-8-15(12-20)9-11-19/h3-7,13-15,20H,8-12H2,1-2H3,(H,18,21)
InChIKeyOWFKCCVEAMGDKI-UHFFFAOYSA-N
XLogP1.96
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 ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-[4-[1-oxo-1-(1-phenylethylamino)propan-2-yl]piperazin-1-yl]propanamide
CID 46697935
N-benzhydryl-2-[3-(hydroxymethyl)pyrrolidin-1-yl]propanamide
CID 111543768
2-[4-(hydroxymethyl)piperidin-1-yl]-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 110891645
2-(4-ethylpiperazin-1-yl)-N-(1-phenylethyl)propanamide
CID 78787136
(2R)-2-morpholin-4-yl-N-[(1S)-1-phenylethyl]propanamide
CID 27067773
2-morpholin-4-yl-N-(1-phenylethyl)propanamide
CID 42913456
(2R)-N-[(1S)-1-phenylethyl]-2-(4-phenylpiperazin-1-yl)propanamide
CID 40940116
2-(3-methylpiperidin-1-yl)-N-(1-phenylethyl)propanamide
CID 46800680
2-[4-(acetamidomethyl)piperidin-1-yl]-N-benzhydrylpropanamide
CID 55841833
4-(hydroxymethyl)-N-[1-(4-phenylphenyl)ethyl]piperidine-1-carboxamide
CID 110894921
N-cyclohexyl-4-[1-oxo-1-(1-phenylethylamino)propan-2-yl]piperazine-1-carboxamide
CID 112818881
N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide
CID 51167538

Frequently Asked Questions

What is the IUPAC name of 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide?
The IUPAC name of 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide (CID 75810047) is 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide.
What is the SMILES notation for 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide?
The canonical SMILES for 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide is CC(NC(=O)C(C)N1CCC(CO)CC1)c1ccccc1.
What is the InChIKey of 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide?
The InChIKey is OWFKCCVEAMGDKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13(16-6-4-3-5-7-16)18-17(21)14(2)19-10-8-15(12-20)9-11-19/h3-7,13-15,20H,8-12H2,1-2H3,(H,18,21).
What are the key properties of 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide?
2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide has a molecular weight of 290.41 g/mol, XLogP of 1.96, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide is sourced from PubChem (CID 75810047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).