1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine

C15H19N3 — CID 22968799

IUPAC1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine
SMILESCNc1ccccc1N(C)c1ccccc1NC
InChIInChI=1S/C15H19N3/c1-16-12-8-4-6-10-14(12)18(3)15-11-7-5-9-13(15)17-2/h4-11,16-17H,1-3H3
InChIKeyRTAJZDWTTITNFN-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.54
Rot. Bonds4

About 1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine

1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine (PubChem CID 22968799) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine.

Molecular Properties

Compound Name1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine
PubChem CID22968799
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine
SMILESCNc1ccccc1N(C)c1ccccc1NC
InChIInChI=1S/C15H19N3/c1-16-12-8-4-6-10-14(12)18(3)15-11-7-5-9-13(15)17-2/h4-11,16-17H,1-3H3
InChIKeyRTAJZDWTTITNFN-UHFFFAOYSA-N
XLogP3.54
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine?
The IUPAC name of 1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine (CID 22968799) is 1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine.
What is the SMILES notation for 1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine?
The canonical SMILES for 1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine is CNc1ccccc1N(C)c1ccccc1NC.
What is the InChIKey of 1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine?
The InChIKey is RTAJZDWTTITNFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-16-12-8-4-6-10-14(12)18(3)15-11-7-5-9-13(15)17-2/h4-11,16-17H,1-3H3.
What are the key properties of 1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine?
1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine has a molecular weight of 241.34 g/mol, XLogP of 3.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N-dimethyl-2-N-[2-(methylamino)phenyl]benzene-1,2-diamine is sourced from PubChem (CID 22968799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).