N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide

C18H15Cl2N3O — CID 9339333

IUPACN-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide
SMILESCc1c(Cl)cccc1NC(=O)CNc1ccnc2cc(Cl)ccc12
InChIInChI=1S/C18H15Cl2N3O/c1-11-14(20)3-2-4-15(11)23-18(24)10-22-16-7-8-21-17-9-12(19)5-6-13(16)17/h2-9H,10H2,1H3,(H,21,22)(H,23,24)
InChIKeyPDDFESJFVOVSLL-UHFFFAOYSA-N
MW360.24 g/mol
LogP4.90
Rot. Bonds4

About N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide

N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide (PubChem CID 9339333) has the molecular formula C18H15Cl2N3O and a molecular weight of 360.24 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide
PubChem CID9339333
Molecular FormulaC18H15Cl2N3O
Molecular Weight360.24 g/mol
Exact Mass359.06
IUPAC NameN-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide
SMILESCc1c(Cl)cccc1NC(=O)CNc1ccnc2cc(Cl)ccc12
InChIInChI=1S/C18H15Cl2N3O/c1-11-14(20)3-2-4-15(11)23-18(24)10-22-16-7-8-21-17-9-12(19)5-6-13(16)17/h2-9H,10H2,1H3,(H,21,22)(H,23,24)
InChIKeyPDDFESJFVOVSLL-UHFFFAOYSA-N
XLogP4.90
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.24
LogP ≤ 54.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-chloro-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 2541105
2-(3-chloro-2-methylanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 9099221
N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide
CID 33162844
N-(3-chloro-2-methylphenyl)-2-(2-fluoroanilino)acetamide
CID 2604427
N-butyl-2-[(7-chloroquinolin-4-yl)amino]acetamide;hydrochloride
CID 12742474
N-[3-[[2-(3-chloro-2-methylanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54814911
2-(3-chloro-2-methylanilino)-N-(2-fluorophenyl)acetamide
CID 9099260
N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide
CID 9101959
3-[(7-chloroquinolin-4-yl)amino]-2,2-dimethylpropanoic acid
CID 113307879
2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide
CID 9098705
N-(4-chloro-2-methylphenyl)-2-(2,3-dimethylanilino)acetamide
CID 7636870
3-[(7-chloroquinolin-4-yl)amino]-N-propylpropanamide
CID 61065277

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide (CID 9339333) is N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide is Cc1c(Cl)cccc1NC(=O)CNc1ccnc2cc(Cl)ccc12.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide?
The InChIKey is PDDFESJFVOVSLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2N3O/c1-11-14(20)3-2-4-15(11)23-18(24)10-22-16-7-8-21-17-9-12(19)5-6-13(16)17/h2-9H,10H2,1H3,(H,21,22)(H,23,24).
What are the key properties of N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide?
N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide has a molecular weight of 360.24 g/mol, XLogP of 4.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-2-[(7-chloroquinolin-4-yl)amino]acetamide is sourced from PubChem (CID 9339333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).