N-methyl-3-(4-propan-2-ylphenyl)propanamide

C13H19NO — CID 41455606

IUPACN-methyl-3-(4-propan-2-ylphenyl)propanamide
SMILESCNC(=O)CCc1ccc(C(C)C)cc1
InChIInChI=1S/C13H19NO/c1-10(2)12-7-4-11(5-8-12)6-9-13(15)14-3/h4-5,7-8,10H,6,9H2,1-3H3,(H,14,15)
InChIKeyJPIWUSWYMMIEFH-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.49
Rot. Bonds4

About N-methyl-3-(4-propan-2-ylphenyl)propanamide

N-methyl-3-(4-propan-2-ylphenyl)propanamide (PubChem CID 41455606) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N-methyl-3-(4-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound NameN-methyl-3-(4-propan-2-ylphenyl)propanamide
PubChem CID41455606
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN-methyl-3-(4-propan-2-ylphenyl)propanamide
SMILESCNC(=O)CCc1ccc(C(C)C)cc1
InChIInChI=1S/C13H19NO/c1-10(2)12-7-4-11(5-8-12)6-9-13(15)14-3/h4-5,7-8,10H,6,9H2,1-3H3,(H,14,15)
InChIKeyJPIWUSWYMMIEFH-UHFFFAOYSA-N
XLogP2.49
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-3-(3-propan-2-ylphenyl)propanamide
CID 122496353
3-[3-(4-propan-2-ylphenyl)propanoylamino]butanoic acid
CID 119221299
N-(4-hydroxyphenyl)-3-(4-propan-2-ylphenyl)propanamide
CID 56659537
N-[2-(ethylamino)ethyl]-3-(4-propan-2-ylphenyl)propanamide
CID 119509353
N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide
CID 19221387
ethane;3-(4-propan-2-ylphenyl)propanamide
CID 142410323
3-phenyl-N-(4-propan-2-ylphenyl)propanamide
CID 819687
2,2-dimethyl-3-[3-(4-propan-2-ylphenyl)propanoylamino]propanoic acid
CID 119250000
N-(2,6-diethylphenyl)-3-(4-propan-2-ylphenyl)propanamide
CID 19221408
1-amino-4-(4-propan-2-ylphenyl)butan-2-one
CID 95439232
N-[(4-methylsulfonylphenyl)methyl]-3-(4-propan-2-ylphenyl)propanamide
CID 60511799
N-[3-(aminomethyl)pentan-3-yl]-3-(4-propan-2-ylphenyl)propanamide;hydrochloride
CID 119571934

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(4-propan-2-ylphenyl)propanamide?
The IUPAC name of N-methyl-3-(4-propan-2-ylphenyl)propanamide (CID 41455606) is N-methyl-3-(4-propan-2-ylphenyl)propanamide.
What is the SMILES notation for N-methyl-3-(4-propan-2-ylphenyl)propanamide?
The canonical SMILES for N-methyl-3-(4-propan-2-ylphenyl)propanamide is CNC(=O)CCc1ccc(C(C)C)cc1.
What is the InChIKey of N-methyl-3-(4-propan-2-ylphenyl)propanamide?
The InChIKey is JPIWUSWYMMIEFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10(2)12-7-4-11(5-8-12)6-9-13(15)14-3/h4-5,7-8,10H,6,9H2,1-3H3,(H,14,15).
What are the key properties of N-methyl-3-(4-propan-2-ylphenyl)propanamide?
N-methyl-3-(4-propan-2-ylphenyl)propanamide has a molecular weight of 205.30 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(4-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 41455606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).