N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide

C23H39NO2 — CID 71684357

IUPACN-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)N[C@H](C)C(O)c1ccccc1
InChIInChI=1S/C23H39NO2/c1-3-4-5-6-7-8-9-10-11-12-16-19-22(25)24-20(2)23(26)21-17-14-13-15-18-21/h13-15,17-18,20,23,26H,3-12,16,19H2,1-2H3,(H,24,25)/t20-,23?/m1/s1
InChIKeyYLAZEWZHIRBZDA-PPUHSXQSSA-N
MW361.57 g/mol
LogP5.93
Rot. Bonds15

About N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide

N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide (PubChem CID 71684357) has the molecular formula C23H39NO2 and a molecular weight of 361.57 g/mol. Its IUPAC name is N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide.

Molecular Properties

Compound NameN-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide
PubChem CID71684357
Molecular FormulaC23H39NO2
Molecular Weight361.57 g/mol
Exact Mass361.30
IUPAC NameN-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)N[C@H](C)C(O)c1ccccc1
InChIInChI=1S/C23H39NO2/c1-3-4-5-6-7-8-9-10-11-12-16-19-22(25)24-20(2)23(26)21-17-14-13-15-18-21/h13-15,17-18,20,23,26H,3-12,16,19H2,1-2H3,(H,24,25)/t20-,23?/m1/s1
InChIKeyYLAZEWZHIRBZDA-PPUHSXQSSA-N
XLogP5.93
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.57
LogP ≤ 55.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]octanamide
CID 101078871
12-(dimethylamino)-N-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]dodecanamide
CID 71524721
N-[(1S)-1-phenylethyl]decanamide
CID 98131360
[(1R,2S)-2-(dodecanoylamino)-1-phenylpropyl] N-butylcarbamate
CID 101078873
(2S)-2-(hexanoylamino)-2-phenylacetic acid
CID 28880777
(1S,2S)-1-hydroxy-2-methyl-1-phenylnonan-3-one
CID 102384202
N-(2-chloro-1-phenylethyl)octanamide
CID 113272309
N,N'-bis[(1S)-1-phenylethyl]pentadecanediamide
CID 102132499
(9Z,12E)-N-[(1R)-1-phenylethyl]octadeca-9,12-dienamide
CID 71588891
N-[(2S)-1-phenylpropan-2-yl]heptanamide
CID 102304960
(5R)-5-hydroxy-N-[(1S)-1-phenylethyl]decanamide
CID 11543858
[(2R)-2-(dodecanoylamino)-2-phenylethyl]carbamic acid
CID 67913525

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide?
The IUPAC name of N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide (CID 71684357) is N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide.
What is the SMILES notation for N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide?
The canonical SMILES for N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide is CCCCCCCCCCCCCC(=O)N[C@H](C)C(O)c1ccccc1.
What is the InChIKey of N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide?
The InChIKey is YLAZEWZHIRBZDA-PPUHSXQSSA-N. The full InChI is InChI=1S/C23H39NO2/c1-3-4-5-6-7-8-9-10-11-12-16-19-22(25)24-20(2)23(26)21-17-14-13-15-18-21/h13-15,17-18,20,23,26H,3-12,16,19H2,1-2H3,(H,24,25)/t20-,23?/m1/s1.
What are the key properties of N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide?
N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide has a molecular weight of 361.57 g/mol, XLogP of 5.93, 15 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-hydroxy-1-phenylpropan-2-yl]tetradecanamide is sourced from PubChem (CID 71684357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).