2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide

C19H18Cl2N2O — CID 6184678

IUPAC2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide
SMILESC/C(=N/NC(=O)c1ccc(Cl)cc1Cl)c1ccc2c(c1)CCCC2
InChIInChI=1S/C19H18Cl2N2O/c1-12(14-7-6-13-4-2-3-5-15(13)10-14)22-23-19(24)17-9-8-16(20)11-18(17)21/h6-11H,2-5H2,1H3,(H,23,24)/b22-12-
InChIKeyUPEIIKCLIQGBJH-UUYOSTAYSA-N
MW361.27 g/mol
LogP5.03
Rot. Bonds3

About 2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide

2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide (PubChem CID 6184678) has the molecular formula C19H18Cl2N2O and a molecular weight of 361.27 g/mol. Its IUPAC name is 2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide
PubChem CID6184678
Molecular FormulaC19H18Cl2N2O
Molecular Weight361.27 g/mol
Exact Mass360.08
IUPAC Name2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide
SMILESC/C(=N/NC(=O)c1ccc(Cl)cc1Cl)c1ccc2c(c1)CCCC2
InChIInChI=1S/C19H18Cl2N2O/c1-12(14-7-6-13-4-2-3-5-15(13)10-14)22-23-19(24)17-9-8-16(20)11-18(17)21/h6-11H,2-5H2,1H3,(H,23,24)/b22-12-
InChIKeyUPEIIKCLIQGBJH-UUYOSTAYSA-N
XLogP5.03
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.27
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2,4-dichloro-N-[1-(4-chlorophenyl)ethylideneamino]benzamide
CID 904479
1-methyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]urea
CID 91942630
2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide
CID 6167444
4-amino-N-[(Z)-1-(2,4-dichlorophenyl)ethylideneamino]benzamide
CID 7955460
2,4-dichloro-N-[3-[N-[(2-chlorobenzoyl)amino]-C-methylcarbonimidoyl]phenyl]benzamide
CID 5078107
3,4-dichloro-N-[(Z)-1-[4-[(2,4-dichlorobenzoyl)amino]phenyl]ethylideneamino]benzamide
CID 6177494
2,4-dichloro-N-[4-[(Z)-N-[(3-chlorobenzoyl)amino]-C-methylcarbonimidoyl]phenyl]benzamide
CID 6266458
N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]pyridine-3-carboxamide
CID 5139408
N,N'-bis[1-[4-[(2,4-dichlorobenzoyl)amino]phenyl]ethylideneamino]butanediamide
CID 3404914
2,4-dichloro-N-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide
CID 135688205
2,4-dichloro-N-[4-[N-[(2-methoxybenzoyl)amino]-C-methylcarbonimidoyl]phenyl]benzamide
CID 4288814
4-propoxy-N-[(E)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide
CID 133169944

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide?
The IUPAC name of 2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide (CID 6184678) is 2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide?
The canonical SMILES for 2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide is C/C(=N/NC(=O)c1ccc(Cl)cc1Cl)c1ccc2c(c1)CCCC2.
What is the InChIKey of 2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide?
The InChIKey is UPEIIKCLIQGBJH-UUYOSTAYSA-N. The full InChI is InChI=1S/C19H18Cl2N2O/c1-12(14-7-6-13-4-2-3-5-15(13)10-14)22-23-19(24)17-9-8-16(20)11-18(17)21/h6-11H,2-5H2,1H3,(H,23,24)/b22-12-.
What are the key properties of 2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide?
2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide has a molecular weight of 361.27 g/mol, XLogP of 5.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide is sourced from PubChem (CID 6184678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).