2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide

C16H24N2O2 — CID 6483916

IUPAC2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN1CCC(c2ccccc2)C(O)C1
InChIInChI=1S/C16H24N2O2/c1-12(2)17-16(20)11-18-9-8-14(15(19)10-18)13-6-4-3-5-7-13/h3-7,12,14-15,19H,8-11H2,1-2H3,(H,17,20)
InChIKeyWQPQTEHVYJHUKY-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.36
Rot. Bonds4

About 2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide

2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide (PubChem CID 6483916) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide
PubChem CID6483916
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN1CCC(c2ccccc2)C(O)C1
InChIInChI=1S/C16H24N2O2/c1-12(2)17-16(20)11-18-9-8-14(15(19)10-18)13-6-4-3-5-7-13/h3-7,12,14-15,19H,8-11H2,1-2H3,(H,17,20)
InChIKeyWQPQTEHVYJHUKY-UHFFFAOYSA-N
XLogP1.36
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,4S,5S)-5-[[(2S)-2-[(2-acetamido-3-phenylpropanoyl)amino]hexanoyl]amino]-N-butyl-6-cyclohexyl-4-hydroxy-2-propan-2-ylhexanamide
CID 44380918
2-amino-N-[(1R,2R)-1-hydroxy-1-phenylpropan-2-yl]-N-methylacetamide
CID 1512505
(2S)-2-amino-N-[(2S,4S)-4-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-hydroxy-1,5-diphenylpentan-2-yl]-3-methylbutanamide
CID 18655622
L-alanyl-N-[(1S,2R)-1-benzyl-2-hydroxypropyl]-L-alaninamide
CID 46937118
2,4-bis(Acetylvalylamino)-1,5-diphenyl-3-pentanol
CID 452447
N,N-bis(AcetylValVal)-2,4-diamino-1,5-diphenyl-3-pentanol
CID 452448
(S)-N-[(S)-1-((S)-2-Hydroxy-1-isobutyl-octylcarbamoyl)-2-methyl-propyl]-3-methyl-2-(3-phenyl-propionylamino)-butyramide
CID 11800384
(2S,4S,5S)-5-[[(2S)-2-[(3S,4R)-3-acetamido-2-oxo-4-phenylpiperidin-1-yl]hexanoyl]amino]-N-butyl-6-cyclohexyl-4-hydroxy-2-propan-2-ylhexanamide
CID 15725562
2-Acetylamino-N-(1-{3-[2-(2-acetylamino-3-methyl-butyrylamino)-3-methyl-butyrylamino]-1-benzyl-2-hydroxy-4-phenyl-butylcarbamoyl}-2-methyl-propyl)-3-methyl-butyramide
CID 44324199
(2S,4R)-N-[(2S)-2,3-dihydroxypropyl]-4-phenylpiperidine-2-carboxamide
CID 156010013
Microsporin B
CID 24763421
(6R)-1-[2-(3-fluorophenyl)ethyl]-6-(1-hydroxyethyl)piperazine-2,3-dione
CID 16745890

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide (CID 6483916) is 2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide is CC(C)NC(=O)CN1CCC(c2ccccc2)C(O)C1.
What is the InChIKey of 2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide?
The InChIKey is WQPQTEHVYJHUKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12(2)17-16(20)11-18-9-8-14(15(19)10-18)13-6-4-3-5-7-13/h3-7,12,14-15,19H,8-11H2,1-2H3,(H,17,20).
What are the key properties of 2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide?
2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide has a molecular weight of 276.38 g/mol, XLogP of 1.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxy-4-phenylpiperidin-1-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 6483916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).