1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine

C18H24N2 — CID 115222121

IUPAC1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine
SMILESCNC(C)(C)CN(C)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H24N2/c1-18(2,19-3)14-20(4)17-12-10-16(11-13-17)15-8-6-5-7-9-15/h5-13,19H,14H2,1-4H3
InChIKeyXIMFZJPLCUWFPC-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.79
Rot. Bonds5

About 1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine

1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine (PubChem CID 115222121) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine.

Molecular Properties

Compound Name1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine
PubChem CID115222121
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine
SMILESCNC(C)(C)CN(C)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H24N2/c1-18(2,19-3)14-20(4)17-12-10-16(11-13-17)15-8-6-5-7-9-15/h5-13,19H,14H2,1-4H3
InChIKeyXIMFZJPLCUWFPC-UHFFFAOYSA-N
XLogP3.79
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-N-methyl-4-phenylaniline
CID 23459365
2-(N-methyl-4-phenylanilino)ethanethiol
CID 115223791
3-(N,4-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
CID 64792121
1-N,1-N-dibenzyl-2-N,2-dimethylpropane-1,2-diamine
CID 62847858
2-(N-methyl-4-phenylanilino)acetonitrile
CID 115130840
N-(4-tert-butylphenyl)-N-methyl-4-phenylaniline
CID 70891344
1-N,2-N,2-trimethyl-1-N-(2,3,5,6-tetramethylphenyl)propane-1,2-diamine
CID 115222118
2-methyl-2-(N-methyl-4-phenylanilino)propan-1-ol
CID 115133254
N-methyl-N-phenylaniline;N-methyl-4-phenyl-N-(4-phenylphenyl)aniline
CID 157333767
1-N-(1H-indol-3-yl)-1-N,2-N,2-trimethylpropane-1,2-diamine
CID 115222133
1-N-(5-chlorothiophen-2-yl)-1-N,2-N,2-trimethylpropane-1,2-diamine
CID 115222109
N-[(1-aminocyclopropyl)methyl]-N-methyl-4-phenylaniline
CID 115256508

Frequently Asked Questions

What is the IUPAC name of 1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine?
The IUPAC name of 1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine (CID 115222121) is 1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine.
What is the SMILES notation for 1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine?
The canonical SMILES for 1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine is CNC(C)(C)CN(C)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine?
The InChIKey is XIMFZJPLCUWFPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-18(2,19-3)14-20(4)17-12-10-16(11-13-17)15-8-6-5-7-9-15/h5-13,19H,14H2,1-4H3.
What are the key properties of 1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine?
1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine has a molecular weight of 268.40 g/mol, XLogP of 3.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N,2-trimethyl-1-N-(4-phenylphenyl)propane-1,2-diamine is sourced from PubChem (CID 115222121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).