(E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide

C16H18N2O2 — CID 18979140

IUPAC(E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide
SMILESO=C(CCCC/C=C/c1ccc2ccccc2n1)NO
InChIInChI=1S/C16H18N2O2/c19-16(18-20)10-4-2-1-3-8-14-12-11-13-7-5-6-9-15(13)17-14/h3,5-9,11-12,20H,1-2,4,10H2,(H,18,19)/b8-3+
InChIKeyAIXORCMGHMZSAW-FPYGCLRLSA-N
MW270.33 g/mol
LogP3.31
Rot. Bonds6

About (E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide

(E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide (PubChem CID 18979140) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is (E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide.

Molecular Properties

Compound Name(E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide
PubChem CID18979140
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name(E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide
SMILESO=C(CCCC/C=C/c1ccc2ccccc2n1)NO
InChIInChI=1S/C16H18N2O2/c19-16(18-20)10-4-2-1-3-8-14-12-11-13-7-5-6-9-15(13)17-14/h3,5-9,11-12,20H,1-2,4,10H2,(H,18,19)/b8-3+
InChIKeyAIXORCMGHMZSAW-FPYGCLRLSA-N
XLogP3.31
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(Z)-N-quinolin-2-yloctadec-9-enamide
CID 145189390
benzyl N-(3-quinolin-2-ylprop-2-enyl)carbamate
CID 169471802
(E)-9-(2-ethynyl-1,3-thiazol-4-yl)-N-hydroxynon-8-enamide
CID 171383213
methyl 3-quinolin-2-ylprop-2-enoate
CID 513392
(E)-N-butyl-3-quinolin-2-ylprop-2-enamide
CID 30282284
(E)-N-(3-aminopropyl)-3-quinolin-2-ylprop-2-enamide
CID 110486554
2-[4-(2-quinolin-2-ylethenyl)phenoxy]acetic acid
CID 4998938
CID 67894241
CID 67894241
2-[(E)-2-phenylethenyl]quinoline;sulfuric acid
CID 75366284
3-[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]propanoic acid
CID 52614181
2-(3-methylbuta-1,3-dienyl)quinoline
CID 1274018
methyl (2E,4E)-5-quinolin-2-ylpenta-2,4-dienoate
CID 11139204

Frequently Asked Questions

What is the IUPAC name of (E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide?
The IUPAC name of (E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide (CID 18979140) is (E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide.
What is the SMILES notation for (E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide?
The canonical SMILES for (E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide is O=C(CCCC/C=C/c1ccc2ccccc2n1)NO.
What is the InChIKey of (E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide?
The InChIKey is AIXORCMGHMZSAW-FPYGCLRLSA-N. The full InChI is InChI=1S/C16H18N2O2/c19-16(18-20)10-4-2-1-3-8-14-12-11-13-7-5-6-9-15(13)17-14/h3,5-9,11-12,20H,1-2,4,10H2,(H,18,19)/b8-3+.
What are the key properties of (E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide?
(E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide has a molecular weight of 270.33 g/mol, XLogP of 3.31, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-hydroxy-7-quinolin-2-ylhept-6-enamide is sourced from PubChem (CID 18979140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).