N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide

C14H21NO3 — CID 112548097

IUPACN-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide
SMILESCC(OCc1ccccc1)C(=O)N(C)C(C)CO
InChIInChI=1S/C14H21NO3/c1-11(9-16)15(3)14(17)12(2)18-10-13-7-5-4-6-8-13/h4-8,11-12,16H,9-10H2,1-3H3
InChIKeyUTVNYMBYHUKCHZ-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.43
Rot. Bonds6

About N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide

N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide (PubChem CID 112548097) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide.

Molecular Properties

Compound NameN-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide
PubChem CID112548097
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC NameN-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide
SMILESCC(OCc1ccccc1)C(=O)N(C)C(C)CO
InChIInChI=1S/C14H21NO3/c1-11(9-16)15(3)14(17)12(2)18-10-13-7-5-4-6-8-13/h4-8,11-12,16H,9-10H2,1-3H3
InChIKeyUTVNYMBYHUKCHZ-UHFFFAOYSA-N
XLogP1.43
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-hydroxypropyl)-2-phenylmethoxy-N-propan-2-ylpropanamide
CID 61039574
3-[2-phenylmethoxypropanoyl(propan-2-yl)amino]propanoic acid
CID 60830240
potassium 2-phenylmethoxypropanoylazanide
CID 143775552
N-(2-hydroxycyclohexyl)-N-methyl-2-phenylmethoxypropanamide
CID 102634873
(2S)-2-[[(2S)-2-phenylmethoxypropanoyl]amino]propanoic acid
CID 10777126
phenyl 2-phenylmethoxypropanoate
CID 15731819
(2S,4S,5S)-5-hydroxy-4-methyl-2-phenylmethoxyheptan-3-one
CID 101232048
N-(1-hydroxypropan-2-yl)-N-methyl-4-phenylbutanamide
CID 113337561
N-(2-aminoethyl)-N-(2-phenylethyl)-2-phenylmethoxypropanamide;hydrochloride
CID 120886275
(2S)-3-hydroxy-2-[methyl-[(2R)-2-phenylmethoxypropyl]amino]propanoic acid
CID 153486993
(4S)-4-phenylmethoxypentan-2-one
CID 13214355
3-methyl-2-phenylmethoxypentan-1-ol
CID 123785184

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide?
The IUPAC name of N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide (CID 112548097) is N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide.
What is the SMILES notation for N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide?
The canonical SMILES for N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide is CC(OCc1ccccc1)C(=O)N(C)C(C)CO.
What is the InChIKey of N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide?
The InChIKey is UTVNYMBYHUKCHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-11(9-16)15(3)14(17)12(2)18-10-13-7-5-4-6-8-13/h4-8,11-12,16H,9-10H2,1-3H3.
What are the key properties of N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide?
N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide has a molecular weight of 251.33 g/mol, XLogP of 1.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypropan-2-yl)-N-methyl-2-phenylmethoxypropanamide is sourced from PubChem (CID 112548097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).