(2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid

C19H21NO3 — CID 119368014

IUPAC(2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid
SMILESCCC(CC(=O)N[C@@H](C(=O)O)c1ccccc1)c1ccccc1
InChIInChI=1S/C19H21NO3/c1-2-14(15-9-5-3-6-10-15)13-17(21)20-18(19(22)23)16-11-7-4-8-12-16/h3-12,14,18H,2,13H2,1H3,(H,20,21)(H,22,23)/t14?,18-/m1/s1
InChIKeyZKFNBYONKWYXDD-XPKAQORNSA-N
MW311.38 g/mol
LogP3.51
Rot. Bonds7

About (2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid

(2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid (PubChem CID 119368014) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is (2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid.

Molecular Properties

Compound Name(2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid
PubChem CID119368014
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name(2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid
SMILESCCC(CC(=O)N[C@@H](C(=O)O)c1ccccc1)c1ccccc1
InChIInChI=1S/C19H21NO3/c1-2-14(15-9-5-3-6-10-15)13-17(21)20-18(19(22)23)16-11-7-4-8-12-16/h3-12,14,18H,2,13H2,1H3,(H,20,21)(H,22,23)/t14?,18-/m1/s1
InChIKeyZKFNBYONKWYXDD-XPKAQORNSA-N
XLogP3.51
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(3-phenylpentanoylamino)propanoic acid
CID 119238309
ethane;2-phenyl-2-(propanoylamino)acetic acid
CID 169177605
(2S)-4-methyl-2-(3-phenylpentanoylamino)pentanoic acid
CID 119362028
ethane;3-phenylpentanoic acid
CID 142147200
2-methyl-3-(3-phenylpentanoylamino)propanoic acid
CID 119237250
(2S)-2-(hexanoylamino)-2-phenylacetic acid
CID 28880777
(2R)-2-phenyl-2-[(2-phenylacetyl)amino]acetic acid
CID 3049856
2-[(2-methoxyacetyl)amino]-2-phenylacetic acid
CID 16776085
(2S)-2-[(2-aminoacetyl)amino]-2-phenylacetic acid;hydrobromide
CID 70535754
2-(3-aminopropanoylamino)-2-phenylacetic acid
CID 61159354
2-[[2-(tert-butylamino)acetyl]amino]-2-phenylacetic acid
CID 79256949
(3S)-3-phenylpentanoyl chloride
CID 42074098

Frequently Asked Questions

What is the IUPAC name of (2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid?
The IUPAC name of (2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid (CID 119368014) is (2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid.
What is the SMILES notation for (2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid?
The canonical SMILES for (2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid is CCC(CC(=O)N[C@@H](C(=O)O)c1ccccc1)c1ccccc1.
What is the InChIKey of (2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid?
The InChIKey is ZKFNBYONKWYXDD-XPKAQORNSA-N. The full InChI is InChI=1S/C19H21NO3/c1-2-14(15-9-5-3-6-10-15)13-17(21)20-18(19(22)23)16-11-7-4-8-12-16/h3-12,14,18H,2,13H2,1H3,(H,20,21)(H,22,23)/t14?,18-/m1/s1.
What are the key properties of (2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid?
(2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid has a molecular weight of 311.38 g/mol, XLogP of 3.51, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid is sourced from PubChem (CID 119368014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).