(4R)-5-oxo-4-(tritylamino)pentanamide

C24H24N2O2 — CID 59270312

IUPAC(4R)-5-oxo-4-(tritylamino)pentanamide
SMILESNC(=O)CC[C@H](C=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H24N2O2/c25-23(28)17-16-22(18-27)26-24(19-10-4-1-5-11-19,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,18,22,26H,16-17H2,(H2,25,28)/t22-/m1/s1
InChIKeyASEHAILKYXKRCX-JOCHJYFZSA-N
MW372.47 g/mol
LogP3.40
Rot. Bonds9

About (4R)-5-oxo-4-(tritylamino)pentanamide

(4R)-5-oxo-4-(tritylamino)pentanamide (PubChem CID 59270312) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is (4R)-5-oxo-4-(tritylamino)pentanamide.

Molecular Properties

Compound Name(4R)-5-oxo-4-(tritylamino)pentanamide
PubChem CID59270312
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name(4R)-5-oxo-4-(tritylamino)pentanamide
SMILESNC(=O)CC[C@H](C=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H24N2O2/c25-23(28)17-16-22(18-27)26-24(19-10-4-1-5-11-19,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,18,22,26H,16-17H2,(H2,25,28)/t22-/m1/s1
InChIKeyASEHAILKYXKRCX-JOCHJYFZSA-N
XLogP3.40
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (4R)-5-oxo-4-(tritylamino)pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(2S)-5-amino-1,5-dioxopentan-2-yl]carbamic acid
CID 162498855
(2S)-3-methyl-2-(tritylamino)butanal
CID 139696692
(2S)-2-(tritylamino)propanal
CID 11723234
5-amino-2-[[2-(diformylamino)-2-phenylpropanoyl]amino]-5-oxopentanoic acid
CID 174866126
(2R)-3-methyl-2-(tritylamino)butanoic acid
CID 40522874
2-(tritylamino)pentanoic acid
CID 70010724
5-amino-2-[(2-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid
CID 62487551
(2S)-3-phenyl-2-[tritio(trityl)amino]propanal
CID 173343799
N-ethylethanamine;(2R)-3-methylsulfanyl-2-(tritylamino)propanoic acid
CID 90477349
(2R)-2-amino-5-oxo-5-(tritylamino)pentanoic acid
CID 7408406
(2S)-5-amino-2-anilino-5-oxopentanoic acid
CID 54197392
4-formamido-4-(4-phenyl-1,3-thiazol-2-yl)butanamide
CID 156868921

Frequently Asked Questions

What is the IUPAC name of (4R)-5-oxo-4-(tritylamino)pentanamide?
The IUPAC name of (4R)-5-oxo-4-(tritylamino)pentanamide (CID 59270312) is (4R)-5-oxo-4-(tritylamino)pentanamide.
What is the SMILES notation for (4R)-5-oxo-4-(tritylamino)pentanamide?
The canonical SMILES for (4R)-5-oxo-4-(tritylamino)pentanamide is NC(=O)CC[C@H](C=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (4R)-5-oxo-4-(tritylamino)pentanamide?
The InChIKey is ASEHAILKYXKRCX-JOCHJYFZSA-N. The full InChI is InChI=1S/C24H24N2O2/c25-23(28)17-16-22(18-27)26-24(19-10-4-1-5-11-19,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,18,22,26H,16-17H2,(H2,25,28)/t22-/m1/s1.
What are the key properties of (4R)-5-oxo-4-(tritylamino)pentanamide?
(4R)-5-oxo-4-(tritylamino)pentanamide has a molecular weight of 372.47 g/mol, XLogP of 3.40, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-5-oxo-4-(tritylamino)pentanamide is sourced from PubChem (CID 59270312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).