N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide

C19H18ClN3O3 — CID 31955470

IUPACN'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide
SMILESCOc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc2[nH]c(C)c(C)c2c1
InChIInChI=1S/C19H18ClN3O3/c1-10-11(2)21-16-7-4-12(8-15(10)16)18(24)22-23-19(25)14-6-5-13(20)9-17(14)26-3/h4-9,21H,1-3H3,(H,22,24)(H,23,25)
InChIKeyIEXMOYLUUKOLSK-UHFFFAOYSA-N
MW371.82 g/mol
LogP3.52
Rot. Bonds3

About N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide

N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide (PubChem CID 31955470) has the molecular formula C19H18ClN3O3 and a molecular weight of 371.82 g/mol. Its IUPAC name is N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide.

Molecular Properties

Compound NameN'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide
PubChem CID31955470
Molecular FormulaC19H18ClN3O3
Molecular Weight371.82 g/mol
Exact Mass371.10
IUPAC NameN'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide
SMILESCOc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc2[nH]c(C)c(C)c2c1
InChIInChI=1S/C19H18ClN3O3/c1-10-11(2)21-16-7-4-12(8-15(10)16)18(24)22-23-19(25)14-6-5-13(20)9-17(14)26-3/h4-9,21H,1-3H3,(H,22,24)(H,23,25)
InChIKeyIEXMOYLUUKOLSK-UHFFFAOYSA-N
XLogP3.52
TPSA83.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.82
LogP ≤ 53.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide 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'-benzoyl-4-chloro-2-methoxybenzohydrazide
CID 34594179
2,3-dimethyl-N'-(2-methylfuran-3-carbonyl)-1H-indole-5-carbohydrazide
CID 26849494
4-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 29278893
methyl 2,3-dimethyl-1H-indole-5-carboxylate
CID 11344717
N-[5-chloro-2-(2,2,2-trifluoroethoxy)phenyl]-2,3-dimethyl-1H-indole-5-carboxamide
CID 134027334
N-[2-(4-chlorophenoxy)ethyl]-2,3-dimethyl-1H-indole-5-carboxamide
CID 30503002
N-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-3,4-dimethoxybenzamide
CID 113086011
N'-(4-chloro-2-iodobenzoyl)-3,4-dimethoxybenzohydrazide
CID 39714334
N',N',2,3-tetramethyl-1H-indole-5-carbohydrazide
CID 78911937
5-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-3-methyl-1H-indole-2-carboxamide
CID 113204787
2,3-dimethyl-N-[(2-methylpropan-2-yl)oxy]-1H-indole-5-carboxamide
CID 82725792
3,6-dichloro-N'-(4-chloro-2-methoxybenzoyl)pyridine-2-carbohydrazide
CID 35855860

Frequently Asked Questions

What is the IUPAC name of N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide?
The IUPAC name of N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide (CID 31955470) is N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide.
What is the SMILES notation for N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide?
The canonical SMILES for N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide is COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc2[nH]c(C)c(C)c2c1.
What is the InChIKey of N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide?
The InChIKey is IEXMOYLUUKOLSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O3/c1-10-11(2)21-16-7-4-12(8-15(10)16)18(24)22-23-19(25)14-6-5-13(20)9-17(14)26-3/h4-9,21H,1-3H3,(H,22,24)(H,23,25).
What are the key properties of N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide?
N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide has a molecular weight of 371.82 g/mol, XLogP of 3.52, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-chloro-2-methoxybenzoyl)-2,3-dimethyl-1H-indole-5-carbohydrazide is sourced from PubChem (CID 31955470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).