2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide

C14H21NO2 — CID 61062170

IUPAC2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide
SMILESCCCOc1cc(C)ccc1NC(=O)C(C)C
InChIInChI=1S/C14H21NO2/c1-5-8-17-13-9-11(4)6-7-12(13)15-14(16)10(2)3/h6-7,9-10H,5,8H2,1-4H3,(H,15,16)
InChIKeyYDVIFVWNOUGEGX-UHFFFAOYSA-N
MW235.33 g/mol
LogP3.38
Rot. Bonds5

About 2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide

2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide (PubChem CID 61062170) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide
PubChem CID61062170
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide
SMILESCCCOc1cc(C)ccc1NC(=O)C(C)C
InChIInChI=1S/C14H21NO2/c1-5-8-17-13-9-11(4)6-7-12(13)15-14(16)10(2)3/h6-7,9-10H,5,8H2,1-4H3,(H,15,16)
InChIKeyYDVIFVWNOUGEGX-UHFFFAOYSA-N
XLogP3.38
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methyl-2-propoxyphenyl)-3-(2-methylpropyl)urea
CID 47262023
N-(4-methyl-2-propoxyphenyl)butanamide
CID 61061572
2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide
CID 61062328
2-bromo-N-[2-(2-methoxyethoxy)-4-methylphenyl]propanamide
CID 107904095
2-(tert-butylamino)-N-(4-methyl-2-propoxyphenyl)acetamide
CID 78923766
phenyl N-(4-methyl-2-propoxyphenyl)carbamate
CID 61216988
N-[2-(2-methoxyethoxy)-4-methylphenyl]-2-(methylamino)propanamide
CID 62639493
6-(4-methyl-2-propoxyanilino)-6-oxohexanoic acid
CID 60934555
(2S)-2-amino-N-[2-(2-methoxyethoxy)-4-methylphenyl]pentanamide
CID 107568802
3-(2-ethoxy-4-methylanilino)-2-methyl-3-oxopropanoic acid
CID 114896946
2-amino-N-[2-(2-methoxyethoxy)-4-methylphenyl]butanamide
CID 54862844
1-[2-(diethylamino)ethyl]-3-(4-methyl-2-propoxyphenyl)urea
CID 55925113

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide?
The IUPAC name of 2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide (CID 61062170) is 2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide.
What is the SMILES notation for 2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide?
The canonical SMILES for 2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide is CCCOc1cc(C)ccc1NC(=O)C(C)C.
What is the InChIKey of 2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide?
The InChIKey is YDVIFVWNOUGEGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-5-8-17-13-9-11(4)6-7-12(13)15-14(16)10(2)3/h6-7,9-10H,5,8H2,1-4H3,(H,15,16).
What are the key properties of 2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide?
2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide has a molecular weight of 235.33 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4-methyl-2-propoxyphenyl)propanamide is sourced from PubChem (CID 61062170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).