7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide

C14H14ClN3O — CID 82451849

IUPAC7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide
SMILESCc1cc(Cl)cc2c(C(=O)NN)c3c(nc12)CCC3
InChIInChI=1S/C14H14ClN3O/c1-7-5-8(15)6-10-12(14(19)18-16)9-3-2-4-11(9)17-13(7)10/h5-6H,2-4,16H2,1H3,(H,18,19)
InChIKeyKOLPVGYYDDMMSG-UHFFFAOYSA-N
MW275.74 g/mol
LogP2.29
Rot. Bonds1

About 7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide

7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide (PubChem CID 82451849) has the molecular formula C14H14ClN3O and a molecular weight of 275.74 g/mol. Its IUPAC name is 7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide.

Molecular Properties

Compound Name7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide
PubChem CID82451849
Molecular FormulaC14H14ClN3O
Molecular Weight275.74 g/mol
Exact Mass275.08
IUPAC Name7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide
SMILESCc1cc(Cl)cc2c(C(=O)NN)c3c(nc12)CCC3
InChIInChI=1S/C14H14ClN3O/c1-7-5-8(15)6-10-12(14(19)18-16)9-3-2-4-11(9)17-13(7)10/h5-6H,2-4,16H2,1H3,(H,18,19)
InChIKeyKOLPVGYYDDMMSG-UHFFFAOYSA-N
XLogP2.29
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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'}

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Related Compounds

(7-chloro-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
CID 63482072
3-(7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)propanoic acid
CID 82451847
2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide
CID 14385689
7-bromo-5-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
CID 55192211
7-chloro-5-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 63480982
2-(7-chloro-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)acetonitrile
CID 82451782
7-chloro-N-(3-methylphenyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 108799652
N-(2-acetamidoethyl)-7-chloro-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 108799636
7-methoxy-1,2,3,4-tetrahydroacridine-9-carbohydrazide
CID 82452012
7-propan-2-yl-1,2,3,4-tetrahydroacridine-9-carbohydrazide
CID 82450585
5,7-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboximidamide
CID 82450740
5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 62202722

Frequently Asked Questions

What is the IUPAC name of 7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide?
The IUPAC name of 7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide (CID 82451849) is 7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide.
What is the SMILES notation for 7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide?
The canonical SMILES for 7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide is Cc1cc(Cl)cc2c(C(=O)NN)c3c(nc12)CCC3.
What is the InChIKey of 7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide?
The InChIKey is KOLPVGYYDDMMSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O/c1-7-5-8(15)6-10-12(14(19)18-16)9-3-2-4-11(9)17-13(7)10/h5-6H,2-4,16H2,1H3,(H,18,19).
What are the key properties of 7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide?
7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide has a molecular weight of 275.74 g/mol, XLogP of 2.29, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide is sourced from PubChem (CID 82451849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).