(2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide

C18H20N2O4 — CID 67578365

IUPAC(2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide
SMILESCN(C)C(=O)[C@H](O)[C@@H](O)C(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C18H20N2O4/c1-20(2)18(24)16(22)15(21)17(23)19-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-11,15-16,21-22H,1-2H3,(H,19,23)/t15-,16-/m1/s1
InChIKeyLZSHRMSYLZJPNX-HZPDHXFCSA-N
MW328.37 g/mol
LogP1.10
Rot. Bonds5

About (2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide

(2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide (PubChem CID 67578365) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is (2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide.

Molecular Properties

Compound Name(2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide
PubChem CID67578365
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC Name(2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide
SMILESCN(C)C(=O)[C@H](O)[C@@H](O)C(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C18H20N2O4/c1-20(2)18(24)16(22)15(21)17(23)19-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-11,15-16,21-22H,1-2H3,(H,19,23)/t15-,16-/m1/s1
InChIKeyLZSHRMSYLZJPNX-HZPDHXFCSA-N
XLogP1.10
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide 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)-2-acetamido-N-(2-phenylphenyl)propanamide
CID 95234854
2-methylsulfanyl-N-(2-phenylphenyl)propanamide
CID 43077390
2-(1,3-dioxoisoindol-2-yl)-N-(2-phenylphenyl)propanamide
CID 16546107
(2S)-2-[methyl(methylsulfonyl)amino]-2-phenyl-N-(2-phenylphenyl)acetamide
CID 125058384
[1-acetyloxy-2-oxo-2-(2-phenylanilino)ethyl] acetate
CID 11500814
(2R)-2-phenyl-N-(2-phenylphenyl)butanamide
CID 1328236
(2S)-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-phenylphenyl)propanamide
CID 9049661
2-(4-acetylpiperazin-1-yl)-N-(2-phenylphenyl)propanamide
CID 18078428
oxalic acid;N-(2-phenylphenyl)-2-pyrrolidin-1-ylpropanamide
CID 171668760
(2S)-2-[methyl(2-phenoxyethyl)amino]-N-(2-phenylphenyl)propanamide
CID 8514606
(2R)-2-morpholin-4-yl-N-(2-phenylphenyl)propanamide
CID 1429478
1-cyclopropyl-3-(2-phenylphenyl)urea
CID 47195783

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide?
The IUPAC name of (2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide (CID 67578365) is (2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide.
What is the SMILES notation for (2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide?
The canonical SMILES for (2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide is CN(C)C(=O)[C@H](O)[C@@H](O)C(=O)Nc1ccccc1-c1ccccc1.
What is the InChIKey of (2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide?
The InChIKey is LZSHRMSYLZJPNX-HZPDHXFCSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-20(2)18(24)16(22)15(21)17(23)19-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-11,15-16,21-22H,1-2H3,(H,19,23)/t15-,16-/m1/s1.
What are the key properties of (2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide?
(2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide has a molecular weight of 328.37 g/mol, XLogP of 1.10, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2,3-dihydroxy-N,N-dimethyl-N'-(2-phenylphenyl)butanediamide is sourced from PubChem (CID 67578365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).