1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride

C14H16ClN3O3 — CID 67917651

IUPAC1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride
SMILESCOc1ccc(NNCc2ccc([N+](=O)[O-])cc2)cc1.Cl
InChIInChI=1S/C14H15N3O3.ClH/c1-20-14-8-4-12(5-9-14)16-15-10-11-2-6-13(7-3-11)17(18)19;/h2-9,15-16H,10H2,1H3;1H
InChIKeyASBRQOOVXQZQSK-UHFFFAOYSA-N
MW309.75 g/mol
LogP3.14
Rot. Bonds6

About 1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride

1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride (PubChem CID 67917651) has the molecular formula C14H16ClN3O3 and a molecular weight of 309.75 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride
PubChem CID67917651
Molecular FormulaC14H16ClN3O3
Molecular Weight309.75 g/mol
Exact Mass309.09
IUPAC Name1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride
SMILESCOc1ccc(NNCc2ccc([N+](=O)[O-])cc2)cc1.Cl
InChIInChI=1S/C14H15N3O3.ClH/c1-20-14-8-4-12(5-9-14)16-15-10-11-2-6-13(7-3-11)17(18)19;/h2-9,15-16H,10H2,1H3;1H
InChIKeyASBRQOOVXQZQSK-UHFFFAOYSA-N
XLogP3.14
TPSA76.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.75
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-methoxyphenyl)methyl]-N'-(4-nitrophenyl)oxamide
CID 2889588
(1R)-1-(4-methoxyphenyl)-N-[(4-nitrophenyl)methyl]ethanamine
CID 81367242
N-[(4-methoxyphenyl)methyl]-1-(4-nitrophenyl)ethanamine
CID 43297287
3-methoxy-N-[(4-methoxyphenyl)methyl]-5-nitroaniline
CID 80530893
1-(4-methoxyphenyl)-3-(4-nitrophenyl)thiourea
CID 13237599
2-(4-methoxyphenyl)-N-[(4-nitrophenyl)carbamothioyl]acetamide
CID 2947308
(2S)-N-[(4-methoxyphenyl)methyl]-2-(4-nitrophenyl)propanamide
CID 894490
N-(4-methoxyphenyl)-4-[(4-nitrophenyl)diazenyl]aniline
CID 163545972
3-bromo-5-methoxy-N-[(4-nitrophenyl)methyl]aniline
CID 82857528
N-(4-methoxyphenyl)-4-nitrobenzamide
CID 532159
4-methoxy-N-[(1R)-1-(4-nitrophenyl)ethyl]aniline
CID 101388869
N-[(3-fluoro-5-nitrophenyl)methyl]-1-(4-methoxyphenyl)methanamine
CID 115980254

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride?
The IUPAC name of 1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride (CID 67917651) is 1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride?
The canonical SMILES for 1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride is COc1ccc(NNCc2ccc([N+](=O)[O-])cc2)cc1.Cl.
What is the InChIKey of 1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride?
The InChIKey is ASBRQOOVXQZQSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3.ClH/c1-20-14-8-4-12(5-9-14)16-15-10-11-2-6-13(7-3-11)17(18)19;/h2-9,15-16H,10H2,1H3;1H.
What are the key properties of 1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride?
1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride has a molecular weight of 309.75 g/mol, XLogP of 3.14, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-[(4-nitrophenyl)methyl]hydrazine;hydrochloride is sourced from PubChem (CID 67917651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).