4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide

C17H15ClN2O3 — CID 164608861

IUPAC4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide
SMILESO=C(NO)c1ccc(C(=O)N2CCCc3cc(Cl)ccc32)cc1
InChIInChI=1S/C17H15ClN2O3/c18-14-7-8-15-13(10-14)2-1-9-20(15)17(22)12-5-3-11(4-6-12)16(21)19-23/h3-8,10,23H,1-2,9H2,(H,19,21)
InChIKeyMSMNNUIAFKAWCZ-UHFFFAOYSA-N
MW330.77 g/mol
LogP3.05
Rot. Bonds2

About 4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide

4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide (PubChem CID 164608861) has the molecular formula C17H15ClN2O3 and a molecular weight of 330.77 g/mol. Its IUPAC name is 4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide.

Molecular Properties

Compound Name4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide
PubChem CID164608861
Molecular FormulaC17H15ClN2O3
Molecular Weight330.77 g/mol
Exact Mass330.08
IUPAC Name4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide
SMILESO=C(NO)c1ccc(C(=O)N2CCCc3cc(Cl)ccc32)cc1
InChIInChI=1S/C17H15ClN2O3/c18-14-7-8-15-13(10-14)2-1-9-20(15)17(22)12-5-3-11(4-6-12)16(21)19-23/h3-8,10,23H,1-2,9H2,(H,19,21)
InChIKeyMSMNNUIAFKAWCZ-UHFFFAOYSA-N
XLogP3.05
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.77
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

SW-100
CID 130345472
4-chloro-N-{[1-(3-chlorobenzene-1-carbonyl)-1,2,3,4-tetrahydroquinolin-6-yl]methyl}benzamide
CID 142580447
4-[(7-chloro-2,3,4,5-tetrahydro-1-benzazepin-1-yl)methyl]-N-hydroxybenzamide
CID 164610864
4-{[(4-chlorophenyl)amino]methyl}-N-hydroxybenzamide
CID 25218545
4-[(7-chloro-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)methyl]-N-hydroxybenzamide
CID 164609106
1-(4-Chloro-3-nitrobenzoyl)-1,2,3,4-tetrahydroquinoline
CID 711286
(2-Chloro-4,5-difluoro-phenyl)-(3,4-dihydro-2H-quinolin-1-yl)-methanone
CID 790863
N~1~-(4-chlorophenyl)-N~2~-{2-[4-(4-methylbenzoyl)-1-piperazinyl]ethyl}ethanediamide
CID 4020692
(+/-)-N-(1-(4-chlorobenzoyl)-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylacetamide
CID 10251489
3-Chloro-N-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)-phenyl]-benzamide
CID 10548464
3,5-Dichloro-N-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)-phenyl]-benzamide
CID 10741034
4-{(2S,4R)-1-acetyl-4-[(4-chlorophenyl)amino]-2-methyl-1,2,3,4-tetrahydro-6-quinolinyl}benzamide
CID 68161669

Frequently Asked Questions

What is the IUPAC name of 4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide?
The IUPAC name of 4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide (CID 164608861) is 4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide.
What is the SMILES notation for 4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide?
The canonical SMILES for 4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide is O=C(NO)c1ccc(C(=O)N2CCCc3cc(Cl)ccc32)cc1.
What is the InChIKey of 4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide?
The InChIKey is MSMNNUIAFKAWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O3/c18-14-7-8-15-13(10-14)2-1-9-20(15)17(22)12-5-3-11(4-6-12)16(21)19-23/h3-8,10,23H,1-2,9H2,(H,19,21).
What are the key properties of 4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide?
4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide has a molecular weight of 330.77 g/mol, XLogP of 3.05, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-chloro-3,4-dihydro-2H-quinoline-1-carbonyl)-N-hydroxybenzamide is sourced from PubChem (CID 164608861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).