ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine

C17H24N2 — CID 142921032

IUPACethane;N'-methyl-N,N'-diphenylethane-1,2-diamine
SMILESCC.CN(CCNc1ccccc1)c1ccccc1
InChIInChI=1S/C15H18N2.C2H6/c1-17(15-10-6-3-7-11-15)13-12-16-14-8-4-2-5-9-14;1-2/h2-11,16H,12-13H2,1H3;1-2H3
InChIKeyFZOUEZHIWCHGSF-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.26
Rot. Bonds5

About ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine

ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine (PubChem CID 142921032) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine.

Molecular Properties

Compound Nameethane;N'-methyl-N,N'-diphenylethane-1,2-diamine
PubChem CID142921032
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Nameethane;N'-methyl-N,N'-diphenylethane-1,2-diamine
SMILESCC.CN(CCNc1ccccc1)c1ccccc1
InChIInChI=1S/C15H18N2.C2H6/c1-17(15-10-6-3-7-11-15)13-12-16-14-8-4-2-5-9-14;1-2/h2-11,16H,12-13H2,1H3;1-2H3
InChIKeyFZOUEZHIWCHGSF-UHFFFAOYSA-N
XLogP4.26
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-N'-methyl-N'-phenylethane-1,2-diamine
CID 54807376
N-(3,3-dimethylbutyl)-N'-methyl-N'-phenylethane-1,2-diamine
CID 55085467
ethane;N,N,N'-trimethyl-N'-phenylethane-1,2-diamine
CID 177320801
carbanide;N,N'-dimethyl-N,N'-diphenylethane-1,2-diamine;palladium
CID 22967947
N',N'-bis(2-methylpropyl)-N-phenylethane-1,2-diamine
CID 61378856
N-(3-fluorophenyl)-N'-methyl-N'-(4-methylphenyl)ethane-1,2-diamine
CID 62553754
N'-methyl-N-phenyl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 60892732
N'-(2-anilinoethyl)-N,N,N'-triethylpropane-1,3-diamine
CID 102994521
N-(3-bromophenyl)-N'-(4-fluorophenyl)-N'-methylethane-1,2-diamine
CID 63504087
N'-(3,5-dimethylphenyl)-N'-methyl-N-(3-methylphenyl)ethane-1,2-diamine
CID 63501684
4-methyl-1-N-[3-(N-methylanilino)propyl]benzene-1,3-diamine
CID 62910733
N-(1H-benzimidazol-2-yl)-N'-methyl-N'-phenylethane-1,2-diamine
CID 146123718

Frequently Asked Questions

What is the IUPAC name of ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine?
The IUPAC name of ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine (CID 142921032) is ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine.
What is the SMILES notation for ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine?
The canonical SMILES for ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine is CC.CN(CCNc1ccccc1)c1ccccc1.
What is the InChIKey of ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine?
The InChIKey is FZOUEZHIWCHGSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2.C2H6/c1-17(15-10-6-3-7-11-15)13-12-16-14-8-4-2-5-9-14;1-2/h2-11,16H,12-13H2,1H3;1-2H3.
What are the key properties of ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine?
ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine has a molecular weight of 256.39 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N'-methyl-N,N'-diphenylethane-1,2-diamine is sourced from PubChem (CID 142921032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).