1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide

C16H23N3O2 — CID 82522239

IUPAC1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide
SMILESNNC(=O)c1cc2c(n(C3CCCCC3)c1=O)CCCC2
InChIInChI=1S/C16H23N3O2/c17-18-15(20)13-10-11-6-4-5-9-14(11)19(16(13)21)12-7-2-1-3-8-12/h10,12H,1-9,17H2,(H,18,20)
InChIKeySDLUTYKGPWFGMM-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.84
Rot. Bonds2

About 1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide

1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide (PubChem CID 82522239) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide.

Molecular Properties

Compound Name1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide
PubChem CID82522239
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide
SMILESNNC(=O)c1cc2c(n(C3CCCCC3)c1=O)CCCC2
InChIInChI=1S/C16H23N3O2/c17-18-15(20)13-10-11-6-4-5-9-14(11)19(16(13)21)12-7-2-1-3-8-12/h10,12H,1-9,17H2,(H,18,20)
InChIKeySDLUTYKGPWFGMM-UHFFFAOYSA-N
XLogP1.84
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbonyl chloride
CID 82522241
1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbothioamide
CID 82522253
1-cyclopropyl-2-oxo-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbothioamide
CID 82523116
2-(1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinolin-3-yl)acetonitrile
CID 82522250
3-(1-aminoethyl)-1-cyclopentyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one
CID 82522850
3-(aminomethyl)-1-cyclopentyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one
CID 82189071
1-cyclopentyl-3-(hydroxymethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one
CID 82522879
2-oxo-1-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbohydrazide
CID 82522709
3-(1-cyclopentyl-2-oxo-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)propanoyl chloride
CID 82522847
1-[[1-(cyclohexylmethyl)-2-oxo-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonyl]amino]cyclopropane-1-carboxylic acid
CID 67520058
3-(1-aminoethyl)-1-cyclopropyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one
CID 82523085
1-cyclopentyl-3-[(cyclopentylamino)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one
CID 82522868

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide?
The IUPAC name of 1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide (CID 82522239) is 1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide.
What is the SMILES notation for 1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide?
The canonical SMILES for 1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide is NNC(=O)c1cc2c(n(C3CCCCC3)c1=O)CCCC2.
What is the InChIKey of 1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide?
The InChIKey is SDLUTYKGPWFGMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c17-18-15(20)13-10-11-6-4-5-9-14(11)19(16(13)21)12-7-2-1-3-8-12/h10,12H,1-9,17H2,(H,18,20).
What are the key properties of 1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide?
1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide has a molecular weight of 289.38 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-oxo-5,6,7,8-tetrahydroquinoline-3-carbohydrazide is sourced from PubChem (CID 82522239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).