3-phenyl-N-(3-propan-2-ylphenyl)propanamide

C18H21NO — CID 112765575

IUPAC3-phenyl-N-(3-propan-2-ylphenyl)propanamide
SMILESCC(C)c1cccc(NC(=O)CCc2ccccc2)c1
InChIInChI=1S/C18H21NO/c1-14(2)16-9-6-10-17(13-16)19-18(20)12-11-15-7-4-3-5-8-15/h3-10,13-14H,11-12H2,1-2H3,(H,19,20)
InChIKeyYXYMGZWLRCDHAK-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.38
Rot. Bonds5

About 3-phenyl-N-(3-propan-2-ylphenyl)propanamide

3-phenyl-N-(3-propan-2-ylphenyl)propanamide (PubChem CID 112765575) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 3-phenyl-N-(3-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound Name3-phenyl-N-(3-propan-2-ylphenyl)propanamide
PubChem CID112765575
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name3-phenyl-N-(3-propan-2-ylphenyl)propanamide
SMILESCC(C)c1cccc(NC(=O)CCc2ccccc2)c1
InChIInChI=1S/C18H21NO/c1-14(2)16-9-6-10-17(13-16)19-18(20)12-11-15-7-4-3-5-8-15/h3-10,13-14H,11-12H2,1-2H3,(H,19,20)
InChIKeyYXYMGZWLRCDHAK-UHFFFAOYSA-N
XLogP4.38
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(3-methoxyphenyl)-N-(3-propan-2-ylphenyl)propanamide
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3-phenyl-N-(4-propan-2-ylphenyl)propanamide
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3-oxo-3-(3-propan-2-ylanilino)propanoic acid
CID 62230571
2-[3-(3-phenylpropanoylamino)phenyl]acetic acid
CID 28759486
3-methyl-N-(3-propan-2-ylphenyl)butanamide
CID 21491914
3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide
CID 43123771
5-oxo-5-[3-(3-phenylpropanoylamino)anilino]pentanoic acid
CID 17222888
N-methyl-3-(3-propan-2-ylphenyl)propanamide
CID 122496353
N-[3-(3-methylbutoxy)phenyl]-3-phenylpropanamide
CID 17097232
2-(2-hydroxyphenyl)-N-(3-propan-2-ylphenyl)acetamide
CID 78990924
N-[3-[3-(3-aminophenyl)propanoylamino]phenyl]-3-phenylpropanamide
CID 54795568

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-(3-propan-2-ylphenyl)propanamide?
The IUPAC name of 3-phenyl-N-(3-propan-2-ylphenyl)propanamide (CID 112765575) is 3-phenyl-N-(3-propan-2-ylphenyl)propanamide.
What is the SMILES notation for 3-phenyl-N-(3-propan-2-ylphenyl)propanamide?
The canonical SMILES for 3-phenyl-N-(3-propan-2-ylphenyl)propanamide is CC(C)c1cccc(NC(=O)CCc2ccccc2)c1.
What is the InChIKey of 3-phenyl-N-(3-propan-2-ylphenyl)propanamide?
The InChIKey is YXYMGZWLRCDHAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-14(2)16-9-6-10-17(13-16)19-18(20)12-11-15-7-4-3-5-8-15/h3-10,13-14H,11-12H2,1-2H3,(H,19,20).
What are the key properties of 3-phenyl-N-(3-propan-2-ylphenyl)propanamide?
3-phenyl-N-(3-propan-2-ylphenyl)propanamide has a molecular weight of 267.37 g/mol, XLogP of 4.38, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-(3-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 112765575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).