N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine

C19H26N2 — CID 43272040

IUPACN'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine
SMILESCC(C)CN(C)C(c1ccccc1)C(N)c1ccccc1
InChIInChI=1S/C19H26N2/c1-15(2)14-21(3)19(17-12-8-5-9-13-17)18(20)16-10-6-4-7-11-16/h4-13,15,18-19H,14,20H2,1-3H3
InChIKeyKGMRPIAJBISBRT-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.02
Rot. Bonds6

About N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine

N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine (PubChem CID 43272040) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine.

Molecular Properties

Compound NameN'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine
PubChem CID43272040
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC NameN'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine
SMILESCC(C)CN(C)C(c1ccccc1)C(N)c1ccccc1
InChIInChI=1S/C19H26N2/c1-15(2)14-21(3)19(17-12-8-5-9-13-17)18(20)16-10-6-4-7-11-16/h4-13,15,18-19H,14,20H2,1-3H3
InChIKeyKGMRPIAJBISBRT-UHFFFAOYSA-N
XLogP4.02
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine?
The IUPAC name of N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine (CID 43272040) is N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine.
What is the SMILES notation for N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine?
The canonical SMILES for N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine is CC(C)CN(C)C(c1ccccc1)C(N)c1ccccc1.
What is the InChIKey of N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine?
The InChIKey is KGMRPIAJBISBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-15(2)14-21(3)19(17-12-8-5-9-13-17)18(20)16-10-6-4-7-11-16/h4-13,15,18-19H,14,20H2,1-3H3.
What are the key properties of N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine?
N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine has a molecular weight of 282.43 g/mol, XLogP of 4.02, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine is sourced from PubChem (CID 43272040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).