2-amino-4-chloro-N-methylbenzohydrazide

C8H10ClN3O — CID 145125072

IUPAC2-amino-4-chloro-N-methylbenzohydrazide
SMILESCN(N)C(=O)c1ccc(Cl)cc1N
InChIInChI=1S/C8H10ClN3O/c1-12(11)8(13)6-3-2-5(9)4-7(6)10/h2-4H,10-11H2,1H3
InChIKeyJZOYJOMJRHKQFI-UHFFFAOYSA-N
MW199.64 g/mol
LogP0.87
Rot. Bonds1

About 2-amino-4-chloro-N-methylbenzohydrazide

2-amino-4-chloro-N-methylbenzohydrazide (PubChem CID 145125072) has the molecular formula C8H10ClN3O and a molecular weight of 199.64 g/mol. Its IUPAC name is 2-amino-4-chloro-N-methylbenzohydrazide.

Molecular Properties

Compound Name2-amino-4-chloro-N-methylbenzohydrazide
PubChem CID145125072
Molecular FormulaC8H10ClN3O
Molecular Weight199.64 g/mol
Exact Mass199.05
IUPAC Name2-amino-4-chloro-N-methylbenzohydrazide
SMILESCN(N)C(=O)c1ccc(Cl)cc1N
InChIInChI=1S/C8H10ClN3O/c1-12(11)8(13)6-3-2-5(9)4-7(6)10/h2-4H,10-11H2,1H3
InChIKeyJZOYJOMJRHKQFI-UHFFFAOYSA-N
XLogP0.87
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-amino-4-chloro-N,N-diethylbenzamide
CID 16773722
2-amino-4-chloro-N-(2-hydroxyethyl)-N-methylbenzamide
CID 43345854
2-amino-4-chloro-N-(2-hydroxypropyl)-N-methylbenzamide
CID 62334921
2-amino-4-chloro-N,N-dipropylbenzamide
CID 16771430
2-amino-4-chloro-N-methyl-N-pyridin-4-ylbenzamide
CID 106934198
bis(2-amino-4-chlorophenyl)methanone
CID 15130044
2-amino-4-chloro-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)benzamide
CID 61115159
2-amino-4-chloro-N-methyl-N-(2-methylbutyl)benzamide
CID 43295321
2-amino-4-chloro-N-[2-(ethylamino)-2-oxoethyl]-N-methylbenzamide
CID 61115646
2-amino-N-[(4-bromophenyl)methyl]-4-chloro-N-methylbenzamide
CID 61118172
2-amino-4-chloro-N-phenyl-N-propan-2-ylbenzamide
CID 91395635
azanium 2-amino-4-chlorobenzoate
CID 23030471

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-chloro-N-methylbenzohydrazide?
The IUPAC name of 2-amino-4-chloro-N-methylbenzohydrazide (CID 145125072) is 2-amino-4-chloro-N-methylbenzohydrazide.
What is the SMILES notation for 2-amino-4-chloro-N-methylbenzohydrazide?
The canonical SMILES for 2-amino-4-chloro-N-methylbenzohydrazide is CN(N)C(=O)c1ccc(Cl)cc1N.
What is the InChIKey of 2-amino-4-chloro-N-methylbenzohydrazide?
The InChIKey is JZOYJOMJRHKQFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3O/c1-12(11)8(13)6-3-2-5(9)4-7(6)10/h2-4H,10-11H2,1H3.
What are the key properties of 2-amino-4-chloro-N-methylbenzohydrazide?
2-amino-4-chloro-N-methylbenzohydrazide has a molecular weight of 199.64 g/mol, XLogP of 0.87, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-chloro-N-methylbenzohydrazide is sourced from PubChem (CID 145125072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).