2-amino-3-phenyl-N-propan-2-ylpropanamide

C12H18N2O — CID 15926064

IUPAC2-amino-3-phenyl-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(N)Cc1ccccc1
InChIInChI=1S/C12H18N2O/c1-9(2)14-12(15)11(13)8-10-6-4-3-5-7-10/h3-7,9,11H,8,13H2,1-2H3,(H,14,15)
InChIKeyAPBKTHZSPNCTEN-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.08
Rot. Bonds4

About 2-amino-3-phenyl-N-propan-2-ylpropanamide

2-amino-3-phenyl-N-propan-2-ylpropanamide (PubChem CID 15926064) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-amino-3-phenyl-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-amino-3-phenyl-N-propan-2-ylpropanamide
PubChem CID15926064
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-amino-3-phenyl-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(N)Cc1ccccc1
InChIInChI=1S/C12H18N2O/c1-9(2)14-12(15)11(13)8-10-6-4-3-5-7-10/h3-7,9,11H,8,13H2,1-2H3,(H,14,15)
InChIKeyAPBKTHZSPNCTEN-UHFFFAOYSA-N
XLogP1.08
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]-3-(4-phenylphenyl)propanamide
CID 135306568
(2R)-2-amino-N-butan-2-yl-3-phenylpropanamide
CID 78985447
2-amino-3-phenyl-N-(1-phenylethyl)propanamide
CID 24709310
2-amino-4-phenyl-N-propan-2-ylbutanamide
CID 114924577
2-[2-[(2-amino-3-phenylpropanoyl)amino]propanoylamino]propanoic acid
CID 18223062
[(1R)-1-[[(2S)-2-amino-3-phenylpropanoyl]amino]ethyl]boronic acid
CID 74765736
1-[[(2S)-2-amino-3-phenylpropanoyl]amino]ethylphosphonous acid
CID 22811613
methyl 2-[(2-amino-3-phenylpropanoyl)amino]propanoate;hydrochloride
CID 119291012
2-amino-N-[(1R)-1-cycloheptylethyl]-3-phenylpropanamide
CID 81389396
(2R)-2-amino-N-[(1S)-1-cyclohexylethyl]-3-phenylpropanamide
CID 81386066
(2S)-2-amino-N-[(2S)-2-amino-3-phenylpropanoyl]-3-phenylpropanamide
CID 21116073
methyl (2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-methylbutanoate
CID 11771430

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-phenyl-N-propan-2-ylpropanamide?
The IUPAC name of 2-amino-3-phenyl-N-propan-2-ylpropanamide (CID 15926064) is 2-amino-3-phenyl-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-amino-3-phenyl-N-propan-2-ylpropanamide?
The canonical SMILES for 2-amino-3-phenyl-N-propan-2-ylpropanamide is CC(C)NC(=O)C(N)Cc1ccccc1.
What is the InChIKey of 2-amino-3-phenyl-N-propan-2-ylpropanamide?
The InChIKey is APBKTHZSPNCTEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9(2)14-12(15)11(13)8-10-6-4-3-5-7-10/h3-7,9,11H,8,13H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-3-phenyl-N-propan-2-ylpropanamide?
2-amino-3-phenyl-N-propan-2-ylpropanamide has a molecular weight of 206.29 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-phenyl-N-propan-2-ylpropanamide is sourced from PubChem (CID 15926064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).