1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide

C25H24N2O3 — CID 1277512

IUPAC1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide
SMILESO=C(NC[C@@H]1CCCO1)c1ccccc1C(=O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H24N2O3/c28-24(26-18-21-14-9-17-30-21)22-15-7-8-16-23(22)25(29)27(19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-8,10-13,15-16,21H,9,14,17-18H2,(H,26,28)/t21-/m0/s1
InChIKeyOSBGASJVUORLSJ-NRFANRHFSA-N
MW400.48 g/mol
LogP4.57
Rot. Bonds6

About 1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide

1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide (PubChem CID 1277512) has the molecular formula C25H24N2O3 and a molecular weight of 400.48 g/mol. Its IUPAC name is 1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide
PubChem CID1277512
Molecular FormulaC25H24N2O3
Molecular Weight400.48 g/mol
Exact Mass400.18
IUPAC Name1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide
SMILESO=C(NC[C@@H]1CCCO1)c1ccccc1C(=O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H24N2O3/c28-24(26-18-21-14-9-17-30-21)22-15-7-8-16-23(22)25(29)27(19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-8,10-13,15-16,21H,9,14,17-18H2,(H,26,28)/t21-/m0/s1
InChIKeyOSBGASJVUORLSJ-NRFANRHFSA-N
XLogP4.57
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.48
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide 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

2-chloro-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 668841
N-[[(2S)-oxolan-2-yl]methyl]-2-phenylbenzamide
CID 686682
2-methylsulfanyl-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 2228852
2-[[2-[[(2R)-oxolan-2-yl]methylcarbamoyl]phenyl]carbamoyl]benzoic acid
CID 7471264
N-[[(2R)-oxolan-2-yl]methyl]-N',N'-diphenylbutanediamide
CID 7324082
2-anilino-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 29238764
N-[[(2R)-oxolan-2-yl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide
CID 6927860
2-[methyl(methylsulfonyl)amino]-N-(oxolan-2-ylmethyl)benzamide
CID 2955389
2-(benzenesulfonamido)-N-(oxolan-2-ylmethyl)benzamide
CID 2981527
N-(oxolan-2-ylmethyl)-2-[2-oxo-2-(N-phenylanilino)ethoxy]acetamide
CID 3875158
N-[[(2R)-oxolan-2-yl]methyl]-4-(phenylcarbamoylamino)benzamide
CID 42427521
2-methyl-3-oxo-3-[2-(oxolan-2-ylmethylcarbamoyl)anilino]propanoic acid
CID 154795586

Frequently Asked Questions

What is the IUPAC name of 1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide?
The IUPAC name of 1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide (CID 1277512) is 1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide.
What is the SMILES notation for 1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide?
The canonical SMILES for 1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide is O=C(NC[C@@H]1CCCO1)c1ccccc1C(=O)N(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide?
The InChIKey is OSBGASJVUORLSJ-NRFANRHFSA-N. The full InChI is InChI=1S/C25H24N2O3/c28-24(26-18-21-14-9-17-30-21)22-15-7-8-16-23(22)25(29)27(19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-8,10-13,15-16,21H,9,14,17-18H2,(H,26,28)/t21-/m0/s1.
What are the key properties of 1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide?
1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide has a molecular weight of 400.48 g/mol, XLogP of 4.57, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-[[(2S)-oxolan-2-yl]methyl]-2-N,2-N-diphenylbenzene-1,2-dicarboxamide is sourced from PubChem (CID 1277512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).