2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide

C29H36N2O — CID 19874877

IUPAC2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide
SMILESCC(NCC(c1ccccc1)c1ccccc1)C(=O)Nc1c(C(C)C)cccc1C(C)C
InChIInChI=1S/C29H36N2O/c1-20(2)25-17-12-18-26(21(3)4)28(25)31-29(32)22(5)30-19-27(23-13-8-6-9-14-23)24-15-10-7-11-16-24/h6-18,20-22,27,30H,19H2,1-5H3,(H,31,32)
InChIKeyIUFQWZJISOQXBJ-UHFFFAOYSA-N
MW428.62 g/mol
LogP6.68
Rot. Bonds9

About 2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide

2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide (PubChem CID 19874877) has the molecular formula C29H36N2O and a molecular weight of 428.62 g/mol. Its IUPAC name is 2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide
PubChem CID19874877
Molecular FormulaC29H36N2O
Molecular Weight428.62 g/mol
Exact Mass428.28
IUPAC Name2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide
SMILESCC(NCC(c1ccccc1)c1ccccc1)C(=O)Nc1c(C(C)C)cccc1C(C)C
InChIInChI=1S/C29H36N2O/c1-20(2)25-17-12-18-26(21(3)4)28(25)31-29(32)22(5)30-19-27(23-13-8-6-9-14-23)24-15-10-7-11-16-24/h6-18,20-22,27,30H,19H2,1-5H3,(H,31,32)
InChIKeyIUFQWZJISOQXBJ-UHFFFAOYSA-N
XLogP6.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.62
LogP ≤ 56.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide 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-(2,2-diphenylethylamino)-N-methylpropanamide
CID 103603774
N-[2,6-di(propan-2-yl)phenyl]-2-(1-phenylethylamino)acetamide
CID 4877514
N-[2,6-di(propan-2-yl)phenyl]-2-[[(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 19874968
1-[(2S)-2-amino-2-phenylethyl]-3-[2,6-di(propan-2-yl)phenyl]urea
CID 67941886
N-[2,6-di(propan-2-yl)phenyl]-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131955
(2S)-N-[2,6-di(propan-2-yl)phenyl]-2-phenoxypropanamide
CID 8779154
1,3-bis[2,6-di(propan-2-yl)phenyl]urea
CID 12058189
(2S)-2-amino-N-(2-methyl-6-propan-2-ylphenyl)-2-phenylacetamide
CID 22691784
N-[2,6-di(propan-2-yl)phenyl]benzamide
CID 709320
N-[2,6-di(propan-2-yl)phenyl]benzamide;hydroiodide
CID 175991462
[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl]-[(2R)-2-hydroxy-2-phenylethyl]azanium
CID 2455381
N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide
CID 121296745

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide?
The IUPAC name of 2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide (CID 19874877) is 2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide.
What is the SMILES notation for 2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide?
The canonical SMILES for 2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide is CC(NCC(c1ccccc1)c1ccccc1)C(=O)Nc1c(C(C)C)cccc1C(C)C.
What is the InChIKey of 2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide?
The InChIKey is IUFQWZJISOQXBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H36N2O/c1-20(2)25-17-12-18-26(21(3)4)28(25)31-29(32)22(5)30-19-27(23-13-8-6-9-14-23)24-15-10-7-11-16-24/h6-18,20-22,27,30H,19H2,1-5H3,(H,31,32).
What are the key properties of 2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide?
2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide has a molecular weight of 428.62 g/mol, XLogP of 6.68, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-diphenylethylamino)-N-[2,6-di(propan-2-yl)phenyl]propanamide is sourced from PubChem (CID 19874877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).