2-(benzhydrylamino)-2-phenylpropanenitrile

C22H20N2 — CID 101454893

IUPAC2-(benzhydrylamino)-2-phenylpropanenitrile
SMILESCC(C#N)(NC(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C22H20N2/c1-22(17-23,20-15-9-4-10-16-20)24-21(18-11-5-2-6-12-18)19-13-7-3-8-14-19/h2-16,21,24H,1H3
InChIKeyCTQIYVSQLNCTHL-UHFFFAOYSA-N
MW312.42 g/mol
LogP4.80
Rot. Bonds5

About 2-(benzhydrylamino)-2-phenylpropanenitrile

2-(benzhydrylamino)-2-phenylpropanenitrile (PubChem CID 101454893) has the molecular formula C22H20N2 and a molecular weight of 312.42 g/mol. Its IUPAC name is 2-(benzhydrylamino)-2-phenylpropanenitrile.

Molecular Properties

Compound Name2-(benzhydrylamino)-2-phenylpropanenitrile
PubChem CID101454893
Molecular FormulaC22H20N2
Molecular Weight312.42 g/mol
Exact Mass312.16
IUPAC Name2-(benzhydrylamino)-2-phenylpropanenitrile
SMILESCC(C#N)(NC(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C22H20N2/c1-22(17-23,20-15-9-4-10-16-20)24-21(18-11-5-2-6-12-18)19-13-7-3-8-14-19/h2-16,21,24H,1H3
InChIKeyCTQIYVSQLNCTHL-UHFFFAOYSA-N
XLogP4.80
TPSA35.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(benzhydrylamino)-2-phenylpropanenitrile 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

N-(1-cyano-1-phenylethyl)formamide
CID 174786305
2-(benzhydrylamino)-2-methylpropanoic acid
CID 174216539
N-benzhydryl-1,1,1-trifluoromethanamine
CID 70275590
N-[(1S,2R)-2-(benzhydrylamino)-2-cyano-1,2-diphenylethyl]benzenesulfonamide
CID 134972774
3-amino-2,3-diphenylbutanenitrile
CID 70582958
1-cyano-N-(1-cyano-1-phenylethyl)cyclopropane-1-carboxamide
CID 141319600
2-methyl-N-[phenyl(pyridin-4-yl)methyl]but-3-yn-2-amine
CID 63997325
2-(4-tert-butylphenyl)-2-phenylacetonitrile
CID 11414012
cumene;1,4-ditert-butylbenzene;2,2-dimethylpropanedinitrile;methane;2-phenylpropan-2-ylbenzene
CID 161156654
2-(benzhydrylamino)-N-[(1R)-1-cyano-1-cyclopropylethyl]acetamide
CID 7531377
1-phenyl-1-N'-[(1R)-1-phenylethyl]ethane-1,1-diamine
CID 134968939
(2-methyl-3,4-diphenylpentan-2-yl)benzene
CID 173387028

Frequently Asked Questions

What is the IUPAC name of 2-(benzhydrylamino)-2-phenylpropanenitrile?
The IUPAC name of 2-(benzhydrylamino)-2-phenylpropanenitrile (CID 101454893) is 2-(benzhydrylamino)-2-phenylpropanenitrile.
What is the SMILES notation for 2-(benzhydrylamino)-2-phenylpropanenitrile?
The canonical SMILES for 2-(benzhydrylamino)-2-phenylpropanenitrile is CC(C#N)(NC(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(benzhydrylamino)-2-phenylpropanenitrile?
The InChIKey is CTQIYVSQLNCTHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2/c1-22(17-23,20-15-9-4-10-16-20)24-21(18-11-5-2-6-12-18)19-13-7-3-8-14-19/h2-16,21,24H,1H3.
What are the key properties of 2-(benzhydrylamino)-2-phenylpropanenitrile?
2-(benzhydrylamino)-2-phenylpropanenitrile has a molecular weight of 312.42 g/mol, XLogP of 4.80, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzhydrylamino)-2-phenylpropanenitrile is sourced from PubChem (CID 101454893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).