(2R)-2-amino-2-tritylpentanedioic acid

C24H23NO4 — CID 176719720

IUPAC(2R)-2-amino-2-tritylpentanedioic acid
SMILESN[C@@](CCC(=O)O)(C(=O)O)C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H23NO4/c25-23(22(28)29,17-16-21(26)27)24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17,25H2,(H,26,27)(H,28,29)/t23-/m0/s1
InChIKeyOMGAVEYENDPJPM-QHCPKHFHSA-N
MW389.45 g/mol
LogP3.67
Rot. Bonds8

About (2R)-2-amino-2-tritylpentanedioic acid

(2R)-2-amino-2-tritylpentanedioic acid (PubChem CID 176719720) has the molecular formula C24H23NO4 and a molecular weight of 389.45 g/mol. Its IUPAC name is (2R)-2-amino-2-tritylpentanedioic acid.

Molecular Properties

Compound Name(2R)-2-amino-2-tritylpentanedioic acid
PubChem CID176719720
Molecular FormulaC24H23NO4
Molecular Weight389.45 g/mol
Exact Mass389.16
IUPAC Name(2R)-2-amino-2-tritylpentanedioic acid
SMILESN[C@@](CCC(=O)O)(C(=O)O)C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H23NO4/c25-23(22(28)29,17-16-21(26)27)24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17,25H2,(H,26,27)(H,28,29)/t23-/m0/s1
InChIKeyOMGAVEYENDPJPM-QHCPKHFHSA-N
XLogP3.67
TPSA100.62 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.45
LogP ≤ 53.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

4-amino-4-methylsulfanyl-4-phenylbutanoic acid
CID 70122128
3,3-diphenylhexanedioic acid
CID 10469968
2-amino-2-anilinopentanedioic acid
CID 19022725
2-amino-2-(2-phenylacetyl)pentanedioic acid
CID 23292574
2-butyl-2-phenylpentanedioic acid
CID 67892428
2-amino-2-(benzylamino)pentanedioic acid
CID 19080242
(2R)-2-amino-2-benzylsulfanylpentanedioic acid
CID 57316148
5-amino-2,2-difluoro-5-hydroxy-5-phenylpentanoic acid
CID 70349078
3,8-diamino-3-trityloctanoic acid
CID 142728683
4-[amino(diphenyl)methoxy]butanoic acid
CID 23216391
(2S)-2,5-diamino-2-phenylpentanoic acid
CID 7141907
phosphane;6,6,6-triphenylhexanoic acid
CID 175595654

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-tritylpentanedioic acid?
The IUPAC name of (2R)-2-amino-2-tritylpentanedioic acid (CID 176719720) is (2R)-2-amino-2-tritylpentanedioic acid.
What is the SMILES notation for (2R)-2-amino-2-tritylpentanedioic acid?
The canonical SMILES for (2R)-2-amino-2-tritylpentanedioic acid is N[C@@](CCC(=O)O)(C(=O)O)C(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (2R)-2-amino-2-tritylpentanedioic acid?
The InChIKey is OMGAVEYENDPJPM-QHCPKHFHSA-N. The full InChI is InChI=1S/C24H23NO4/c25-23(22(28)29,17-16-21(26)27)24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17,25H2,(H,26,27)(H,28,29)/t23-/m0/s1.
What are the key properties of (2R)-2-amino-2-tritylpentanedioic acid?
(2R)-2-amino-2-tritylpentanedioic acid has a molecular weight of 389.45 g/mol, XLogP of 3.67, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-tritylpentanedioic acid is sourced from PubChem (CID 176719720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).