1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine

C15H19N3 — CID 21331414

IUPAC1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine
SMILESCNc1ccc(N(C)c2ccc(NC)cc2)cc1
InChIInChI=1S/C15H19N3/c1-16-12-4-8-14(9-5-12)18(3)15-10-6-13(17-2)7-11-15/h4-11,16-17H,1-3H3
InChIKeyPPYQXPURRAQOEW-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.54
Rot. Bonds4

About 1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine

1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine (PubChem CID 21331414) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine.

Molecular Properties

Compound Name1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine
PubChem CID21331414
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine
SMILESCNc1ccc(N(C)c2ccc(NC)cc2)cc1
InChIInChI=1S/C15H19N3/c1-16-12-4-8-14(9-5-12)18(3)15-10-6-13(17-2)7-11-15/h4-11,16-17H,1-3H3
InChIKeyPPYQXPURRAQOEW-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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Related Compounds

1-N,4-N-dimethyl-4-N-phenylbenzene-1,4-diamine
CID 57314003
4-N-(4-bromophenyl)-1-N,4-N-dimethylbenzene-1,4-diamine
CID 117029083
1-N,4-N-dimethyl-4-N-(4-nitrosophenyl)benzene-1,4-diamine
CID 174952140
N-methyl-N-[4-(methylamino)phenyl]hydroxylamine
CID 146340340
1-N,4-N-dimethyl-4-N-(2,3,5,6-tetramethylphenyl)benzene-1,4-diamine
CID 117041371
1-N,4-N-dimethyl-4-N-(2,3,4-trimethylphenyl)benzene-1,4-diamine
CID 117041406
4-N-(2,5-dimethylphenyl)-1-N,4-N-dimethylbenzene-1,4-diamine
CID 117029058
4-N-(4-chloro-2-methylphenyl)-1-N,4-N-dimethylbenzene-1,4-diamine
CID 117029080
4-N-[2-(dimethylamino)ethyl]-1-N,4-N-dimethylbenzene-1,4-diamine
CID 117029041
4-N-(1-benzofuran-3-yl)-1-N,4-N-dimethylbenzene-1,4-diamine
CID 117041404
4-N-[4-[4-(N,4-dimethylanilino)-N-methylanilino]phenyl]-1-N,4-N-dimethyl-1-N-(4-methylphenyl)benzene-1,4-diamine
CID 90265189
4-[(dimethylamino)methyl]-N-methylaniline
CID 59619039

Frequently Asked Questions

What is the IUPAC name of 1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine?
The IUPAC name of 1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine (CID 21331414) is 1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine.
What is the SMILES notation for 1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine?
The canonical SMILES for 1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine is CNc1ccc(N(C)c2ccc(NC)cc2)cc1.
What is the InChIKey of 1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine?
The InChIKey is PPYQXPURRAQOEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-16-12-4-8-14(9-5-12)18(3)15-10-6-13(17-2)7-11-15/h4-11,16-17H,1-3H3.
What are the key properties of 1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine?
1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-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,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine is sourced from PubChem (CID 21331414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).