dichloromethane;2-methylpyridine-4-carbohydrazide

C8H11Cl2N3O — CID 157362616

IUPACdichloromethane;2-methylpyridine-4-carbohydrazide
SMILESCc1cc(C(=O)NN)ccn1.ClCCl
InChIInChI=1S/C7H9N3O.CH2Cl2/c1-5-4-6(2-3-9-5)7(11)10-8;2-1-3/h2-4H,8H2,1H3,(H,10,11);1H2
InChIKeyBIUSOUBSEOYLGY-UHFFFAOYSA-N
MW236.10 g/mol
LogP1.42
Rot. Bonds1

About dichloromethane;2-methylpyridine-4-carbohydrazide

dichloromethane;2-methylpyridine-4-carbohydrazide (PubChem CID 157362616) has the molecular formula C8H11Cl2N3O and a molecular weight of 236.10 g/mol. Its IUPAC name is dichloromethane;2-methylpyridine-4-carbohydrazide.

Molecular Properties

Compound Namedichloromethane;2-methylpyridine-4-carbohydrazide
PubChem CID157362616
Molecular FormulaC8H11Cl2N3O
Molecular Weight236.10 g/mol
Exact Mass235.03
IUPAC Namedichloromethane;2-methylpyridine-4-carbohydrazide
SMILESCc1cc(C(=O)NN)ccn1.ClCCl
InChIInChI=1S/C7H9N3O.CH2Cl2/c1-5-4-6(2-3-9-5)7(11)10-8;2-1-3/h2-4H,8H2,1H3,(H,10,11);1H2
InChIKeyBIUSOUBSEOYLGY-UHFFFAOYSA-N
XLogP1.42
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.10
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,2-dimethylpyridine-4-carboxamide;ethane
CID 143416894
N-[(2R)-1-aminopropan-2-yl]-2-methylpyridine-4-carboxamide
CID 106753746
N-(4-aminobutan-2-yl)-2-methylpyridine-4-carboxamide
CID 106752319
N-(4-chloro-2-methylbutyl)-2-methylpyridine-4-carboxamide
CID 106754217
N-[(2S)-2-hydroxypropyl]-2-methylpyridine-4-carboxamide
CID 106753450
N-(2-chloro-3-methylbutyl)-2-methylpyridine-4-carboxamide
CID 106754281
N-(2-chlorobutyl)-2-methylpyridine-4-carboxamide
CID 106754279
N-[(3-chlorocyclopentyl)methyl]-2-methylpyridine-4-carboxamide
CID 106126288
methyl 2-[(2-methylpyridine-4-carbonyl)amino]propanoate
CID 106753807
2-methyl-N-(3-methyl-2-propan-2-ylbutyl)pyridine-4-carboxamide
CID 106753359
N-[2-(ethylamino)ethyl]-2-methylpyridine-4-carboxamide
CID 106753602
2-methyl-N-(pentan-3-ylideneamino)pyridine-4-carboxamide
CID 121001993

Frequently Asked Questions

What is the IUPAC name of dichloromethane;2-methylpyridine-4-carbohydrazide?
The IUPAC name of dichloromethane;2-methylpyridine-4-carbohydrazide (CID 157362616) is dichloromethane;2-methylpyridine-4-carbohydrazide.
What is the SMILES notation for dichloromethane;2-methylpyridine-4-carbohydrazide?
The canonical SMILES for dichloromethane;2-methylpyridine-4-carbohydrazide is Cc1cc(C(=O)NN)ccn1.ClCCl.
What is the InChIKey of dichloromethane;2-methylpyridine-4-carbohydrazide?
The InChIKey is BIUSOUBSEOYLGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O.CH2Cl2/c1-5-4-6(2-3-9-5)7(11)10-8;2-1-3/h2-4H,8H2,1H3,(H,10,11);1H2.
What are the key properties of dichloromethane;2-methylpyridine-4-carbohydrazide?
dichloromethane;2-methylpyridine-4-carbohydrazide has a molecular weight of 236.10 g/mol, XLogP of 1.42, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethane;2-methylpyridine-4-carbohydrazide is sourced from PubChem (CID 157362616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).