2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine

C19H16N4O4 — CID 22895095

IUPAC2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine
SMILESCc1cc([N+](=O)[O-])c(NN(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1
InChIInChI=1S/C19H16N4O4/c1-14-12-17(22(24)25)19(18(13-14)23(26)27)20-21(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,20H,1H3
InChIKeyUMXZTBBPWJYGMN-UHFFFAOYSA-N
MW364.36 g/mol
LogP4.98
Rot. Bonds6

About 2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine

2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine (PubChem CID 22895095) has the molecular formula C19H16N4O4 and a molecular weight of 364.36 g/mol. Its IUPAC name is 2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine.

Molecular Properties

Compound Name2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine
PubChem CID22895095
Molecular FormulaC19H16N4O4
Molecular Weight364.36 g/mol
Exact Mass364.12
IUPAC Name2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine
SMILESCc1cc([N+](=O)[O-])c(NN(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1
InChIInChI=1S/C19H16N4O4/c1-14-12-17(22(24)25)19(18(13-14)23(26)27)20-21(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,20H,1H3
InChIKeyUMXZTBBPWJYGMN-UHFFFAOYSA-N
XLogP4.98
TPSA101.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.36
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-nitrophenyl)-1,1-diphenylhydrazine
CID 23118944
1-phenyl-1-(1,3-thiazol-2-yl)-2-(2,4,6-trinitrophenyl)hydrazine
CID 23118903
1-(1,3-benzoxazol-2-yl)-1-phenyl-2-(2,4,6-trinitrophenyl)hydrazine
CID 87086050
2-(4-methyl-2,6-dinitroanilino)-2-phenylacetic acid
CID 3781177
4-methyl-3-nitro-N',N'-diphenylbenzenesulfonohydrazide
CID 3983594
(2S)-2-(4-methyl-2,6-dinitroanilino)-2-phenylacetate
CID 7085200
2-(3-nitrophenyl)-1,1-diphenylhydrazine
CID 155797950
N,2,4-trimethyl-6-nitroaniline
CID 10583519
1,1-bis[4-(3-ethylhexan-3-yl)phenyl]-2-(2,4,6-trinitrophenyl)hydrazine
CID 2724328
1,2-dinitrobenzene;N,N-diphenylaniline
CID 174468566
3-methyl-4-nitro-N-phenylbenzohydrazide
CID 54532028
2-(5-nitropyrimidin-2-yl)-1,1-diphenylhydrazine
CID 3090119

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine?
The IUPAC name of 2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine (CID 22895095) is 2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine.
What is the SMILES notation for 2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine?
The canonical SMILES for 2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine is Cc1cc([N+](=O)[O-])c(NN(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1.
What is the InChIKey of 2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine?
The InChIKey is UMXZTBBPWJYGMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O4/c1-14-12-17(22(24)25)19(18(13-14)23(26)27)20-21(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,20H,1H3.
What are the key properties of 2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine?
2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine has a molecular weight of 364.36 g/mol, XLogP of 4.98, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-2,6-dinitrophenyl)-1,1-diphenylhydrazine is sourced from PubChem (CID 22895095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).