(4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine

C14H15ClIN3 — CID 107607966

IUPAC(4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine
SMILESNNc1c2c(nc3c(Cl)cc(I)cc13)CCCCC2
InChIInChI=1S/C14H15ClIN3/c15-11-7-8(16)6-10-13(19-17)9-4-2-1-3-5-12(9)18-14(10)11/h6-7H,1-5,17H2,(H,18,19)
InChIKeyZLGWISXAEKPYPV-UHFFFAOYSA-N
MW387.65 g/mol
LogP4.05
Rot. Bonds1

About (4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine

(4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine (PubChem CID 107607966) has the molecular formula C14H15ClIN3 and a molecular weight of 387.65 g/mol. Its IUPAC name is (4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine.

Molecular Properties

Compound Name(4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine
PubChem CID107607966
Molecular FormulaC14H15ClIN3
Molecular Weight387.65 g/mol
Exact Mass387.00
IUPAC Name(4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine
SMILESNNc1c2c(nc3c(Cl)cc(I)cc13)CCCCC2
InChIInChI=1S/C14H15ClIN3/c15-11-7-8(16)6-10-13(19-17)9-4-2-1-3-5-12(9)18-14(10)11/h6-7H,1-5,17H2,(H,18,19)
InChIKeyZLGWISXAEKPYPV-UHFFFAOYSA-N
XLogP4.05
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.65
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'iodine', '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
(7-chloro-5-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
CID 62251323
(7-bromo-5,6-dichloro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
CID 114002173
(3-iodo-4-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine
CID 114257979
(2-bromo-4-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine
CID 63481881
5-chloro-N,7-dimethyl-1,2,3,4-tetrahydroacridin-9-amine
CID 63480213
(7-bromo-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
CID 63482059
2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63480718
(1-chloro-4-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine
CID 55195202
4-chloro-2-fluoro-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63479762
(1,3-dichloro-2-fluoro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine
CID 107579086
(6-fluoro-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
CID 62251732

Frequently Asked Questions

What is the IUPAC name of (4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine?
The IUPAC name of (4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine (CID 107607966) is (4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine.
What is the SMILES notation for (4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine?
The canonical SMILES for (4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine is NNc1c2c(nc3c(Cl)cc(I)cc13)CCCCC2.
What is the InChIKey of (4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine?
The InChIKey is ZLGWISXAEKPYPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClIN3/c15-11-7-8(16)6-10-13(19-17)9-4-2-1-3-5-12(9)18-14(10)11/h6-7H,1-5,17H2,(H,18,19).
What are the key properties of (4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine?
(4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine has a molecular weight of 387.65 g/mol, XLogP of 4.05, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-2-iodo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine is sourced from PubChem (CID 107607966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).