2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid

C15H20N2O3 — CID 62487893

IUPAC2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid
SMILESCC(N)(C(=O)NC(C)(C(=O)O)C1CC1)c1ccccc1
InChIInChI=1S/C15H20N2O3/c1-14(16,10-6-4-3-5-7-10)12(18)17-15(2,13(19)20)11-8-9-11/h3-7,11H,8-9,16H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyVFHCIYXEBHADLZ-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.23
Rot. Bonds5

About 2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid

2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid (PubChem CID 62487893) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid.

Molecular Properties

Compound Name2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid
PubChem CID62487893
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid
SMILESCC(N)(C(=O)NC(C)(C(=O)O)C1CC1)c1ccccc1
InChIInChI=1S/C15H20N2O3/c1-14(16,10-6-4-3-5-7-10)12(18)17-15(2,13(19)20)11-8-9-11/h3-7,11H,8-9,16H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyVFHCIYXEBHADLZ-UHFFFAOYSA-N
XLogP1.23
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-amino-2-ethylbutanoyl)amino]-2-cyclopropylpropanoic acid
CID 79812599
2-amino-N-cycloheptyl-2-phenylpropanamide;hydrochloride
CID 120586523
2-amino-N-(1-cyclopropylethyl)-2-phenylpropanamide
CID 55078586
2-amino-N-(2-cyclopentylethyl)-2-phenylpropanamide;hydrochloride
CID 120588835
2-cyclopropyl-2-(2-phenoxypropanoylamino)propanoic acid
CID 43360421
2-cyclopropyl-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoic acid
CID 43341261
2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylacetic acid
CID 62696206
2-cyclopropyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
CID 63310465
(2R)-2-cyclopropyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
CID 131697971
(2S)-2-cyclopropyl-2-(1H-indole-2-carbonylamino)propanoic acid
CID 93298046
2-cyclopropyl-2-[(2-iodophenyl)carbamoylamino]propanoic acid
CID 61184318
2-amino-N-(2-methyloxolan-3-yl)-2-phenylpropanamide
CID 82729111

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid?
The IUPAC name of 2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid (CID 62487893) is 2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid.
What is the SMILES notation for 2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid?
The canonical SMILES for 2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid is CC(N)(C(=O)NC(C)(C(=O)O)C1CC1)c1ccccc1.
What is the InChIKey of 2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid?
The InChIKey is VFHCIYXEBHADLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-14(16,10-6-4-3-5-7-10)12(18)17-15(2,13(19)20)11-8-9-11/h3-7,11H,8-9,16H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of 2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid?
2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid has a molecular weight of 276.34 g/mol, XLogP of 1.23, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-phenylpropanoyl)amino]-2-cyclopropylpropanoic acid is sourced from PubChem (CID 62487893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).