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

C18H22N2O — CID 43123771

IUPAC3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide
SMILESCC(C)c1cccc(NC(=O)CC(N)c2ccccc2)c1
InChIInChI=1S/C18H22N2O/c1-13(2)15-9-6-10-16(11-15)20-18(21)12-17(19)14-7-4-3-5-8-14/h3-11,13,17H,12,19H2,1-2H3,(H,20,21)
InChIKeyAHPNAJPJHDUDTA-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.84
Rot. Bonds5

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

3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide (PubChem CID 43123771) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound Name3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide
PubChem CID43123771
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide
SMILESCC(C)c1cccc(NC(=O)CC(N)c2ccccc2)c1
InChIInChI=1S/C18H22N2O/c1-13(2)15-9-6-10-16(11-15)20-18(21)12-17(19)14-7-4-3-5-8-14/h3-11,13,17H,12,19H2,1-2H3,(H,20,21)
InChIKeyAHPNAJPJHDUDTA-UHFFFAOYSA-N
XLogP3.84
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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3-phenyl-N-(3-propan-2-ylphenyl)propanamide
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3-amino-N-(3-hydroxy-4-methoxyphenyl)-3-phenylpropanamide
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(3S)-3-amino-3-(4-methoxyphenyl)-N-phenylpropanamide
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2-(2-hydroxyphenyl)-N-(3-propan-2-ylphenyl)acetamide
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Frequently Asked Questions

What is the IUPAC name of 3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide?
The IUPAC name of 3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide (CID 43123771) is 3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide.
What is the SMILES notation for 3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide?
The canonical SMILES for 3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide is CC(C)c1cccc(NC(=O)CC(N)c2ccccc2)c1.
What is the InChIKey of 3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide?
The InChIKey is AHPNAJPJHDUDTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-13(2)15-9-6-10-16(11-15)20-18(21)12-17(19)14-7-4-3-5-8-14/h3-11,13,17H,12,19H2,1-2H3,(H,20,21).
What are the key properties of 3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide?
3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide has a molecular weight of 282.39 g/mol, XLogP of 3.84, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-phenyl-N-(3-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 43123771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).