4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide

C18H15ClN4O3 — CID 39849255

IUPAC4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide
SMILESCOc1ccccc1C(=O)NNC(=O)c1cnc2ccc(Cl)cc2c1N
InChIInChI=1S/C18H15ClN4O3/c1-26-15-5-3-2-4-11(15)17(24)22-23-18(25)13-9-21-14-7-6-10(19)8-12(14)16(13)20/h2-9H,1H3,(H2,20,21)(H,22,24)(H,23,25)
InChIKeyUXISJWXCKOUDJX-UHFFFAOYSA-N
MW370.80 g/mol
LogP2.55
Rot. Bonds3

About 4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide

4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide (PubChem CID 39849255) has the molecular formula C18H15ClN4O3 and a molecular weight of 370.80 g/mol. Its IUPAC name is 4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide.

Molecular Properties

Compound Name4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide
PubChem CID39849255
Molecular FormulaC18H15ClN4O3
Molecular Weight370.80 g/mol
Exact Mass370.08
IUPAC Name4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide
SMILESCOc1ccccc1C(=O)NNC(=O)c1cnc2ccc(Cl)cc2c1N
InChIInChI=1S/C18H15ClN4O3/c1-26-15-5-3-2-4-11(15)17(24)22-23-18(25)13-9-21-14-7-6-10(19)8-12(14)16(13)20/h2-9H,1H3,(H2,20,21)(H,22,24)(H,23,25)
InChIKeyUXISJWXCKOUDJX-UHFFFAOYSA-N
XLogP2.55
TPSA106.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.80
LogP ≤ 52.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-benzoyl-4-chloro-2-methoxybenzohydrazide
CID 34594179
3,5-dichloro-N'-(2-methoxybenzoyl)benzohydrazide
CID 17133653
4-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 29278893
4-amino-N'-(2-fluorobenzoyl)quinoline-3-carbohydrazide
CID 39849188
5-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 7922079
4-chloro-N'-(2-methoxybenzoyl)-2-methylsulfanylpyrimidine-5-carbohydrazide
CID 18858823
N'-(5-amino-6-chloropyrimidin-4-yl)-2-methoxybenzohydrazide
CID 23477575
methyl 6-chloro-4-phenylquinoline-3-carboxylate
CID 10447368
4-chloro-2-methoxy-N'-(2-phenoxyacetyl)benzohydrazide
CID 29279191
5-chloro-2-methoxy-N'-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoyl]benzohydrazide
CID 43038748
N-(5-chloro-2-fluorophenyl)-2-methoxybenzamide
CID 8759235
N'-(5-chloro-2-methoxybenzoyl)-3,4,5-trimethoxybenzohydrazide
CID 4805458

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide?
The IUPAC name of 4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide (CID 39849255) is 4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide.
What is the SMILES notation for 4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide?
The canonical SMILES for 4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide is COc1ccccc1C(=O)NNC(=O)c1cnc2ccc(Cl)cc2c1N.
What is the InChIKey of 4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide?
The InChIKey is UXISJWXCKOUDJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN4O3/c1-26-15-5-3-2-4-11(15)17(24)22-23-18(25)13-9-21-14-7-6-10(19)8-12(14)16(13)20/h2-9H,1H3,(H2,20,21)(H,22,24)(H,23,25).
What are the key properties of 4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide?
4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide has a molecular weight of 370.80 g/mol, XLogP of 2.55, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-chloro-N'-(2-methoxybenzoyl)quinoline-3-carbohydrazide is sourced from PubChem (CID 39849255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).