2-(4-methoxyphenyl)-N-propan-2-ylpropanamide

C13H19NO2 — CID 154459065

IUPAC2-(4-methoxyphenyl)-N-propan-2-ylpropanamide
SMILESCOc1ccc(C(C)C(=O)NC(C)C)cc1
InChIInChI=1S/C13H19NO2/c1-9(2)14-13(15)10(3)11-5-7-12(16-4)8-6-11/h5-10H,1-4H3,(H,14,15)
InChIKeyZLZYGJGFVXAQBM-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.32
Rot. Bonds4

About 2-(4-methoxyphenyl)-N-propan-2-ylpropanamide

2-(4-methoxyphenyl)-N-propan-2-ylpropanamide (PubChem CID 154459065) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-propan-2-ylpropanamide
PubChem CID154459065
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-(4-methoxyphenyl)-N-propan-2-ylpropanamide
SMILESCOc1ccc(C(C)C(=O)NC(C)C)cc1
InChIInChI=1S/C13H19NO2/c1-9(2)14-13(15)10(3)11-5-7-12(16-4)8-6-11/h5-10H,1-4H3,(H,14,15)
InChIKeyZLZYGJGFVXAQBM-UHFFFAOYSA-N
XLogP2.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-[2-(4-methoxyphenyl)propanoylamino]-3-methylbutanoic acid
CID 119369486
2-(4-methoxyphenyl)-N',N'-dimethylpropanehydrazide
CID 116848056
N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide
CID 175079399
(2S)-N-[(1R)-2-hydroxy-1-(4-methoxyphenyl)ethyl]-2-phenylpropanamide
CID 118730013
(2S)-2-[2-(4-methoxyphenyl)propanoylamino]hexanoic acid
CID 120614449
[(1S)-1-(4-methoxyphenyl)propyl]-[(2R)-1-oxo-1-(propan-2-ylamino)propan-2-yl]azanium
CID 8646266
(2R)-2-(6-methoxynaphthalen-2-yl)-N-[(1S)-1-(4-methoxyphenyl)propyl]propanamide
CID 39951625
(2R)-2-(6-methoxynaphthalen-2-yl)-N-[(2S)-pentan-2-yl]propanamide
CID 95247403
(2R)-2-(6-methoxynaphthalen-2-yl)-N-[(1R)-1-(4-methoxyphenyl)propyl]propanamide
CID 39951624
2-[[cyclopropyl-(4-methoxyphenyl)methyl]amino]-N-propan-2-ylpropanamide
CID 115575468
(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide
CID 92850098
methyl 2-[2-(4-methoxyphenyl)propanoylamino]-2,3-dimethylbutanoate
CID 18413307

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-propan-2-ylpropanamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-propan-2-ylpropanamide (CID 154459065) is 2-(4-methoxyphenyl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-propan-2-ylpropanamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-propan-2-ylpropanamide is COc1ccc(C(C)C(=O)NC(C)C)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-propan-2-ylpropanamide?
The InChIKey is ZLZYGJGFVXAQBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-9(2)14-13(15)10(3)11-5-7-12(16-4)8-6-11/h5-10H,1-4H3,(H,14,15).
What are the key properties of 2-(4-methoxyphenyl)-N-propan-2-ylpropanamide?
2-(4-methoxyphenyl)-N-propan-2-ylpropanamide has a molecular weight of 221.30 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 154459065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).