(5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine

C10H11ClN2O — CID 91546324

IUPAC(5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine
SMILESCOc1cc2c(cc1Cl)CCC2=NN
InChIInChI=1S/C10H11ClN2O/c1-14-10-5-7-6(4-8(10)11)2-3-9(7)13-12/h4-5H,2-3,12H2,1H3
InChIKeyXAKFQYNCVIMQSK-UHFFFAOYSA-N
MW210.66 g/mol
LogP1.96
Rot. Bonds1

About (5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine

(5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine (PubChem CID 91546324) has the molecular formula C10H11ClN2O and a molecular weight of 210.66 g/mol. Its IUPAC name is (5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine.

Molecular Properties

Compound Name(5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine
PubChem CID91546324
Molecular FormulaC10H11ClN2O
Molecular Weight210.66 g/mol
Exact Mass210.06
IUPAC Name(5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine
SMILESCOc1cc2c(cc1Cl)CCC2=NN
InChIInChI=1S/C10H11ClN2O/c1-14-10-5-7-6(4-8(10)11)2-3-9(7)13-12/h4-5H,2-3,12H2,1H3
InChIKeyXAKFQYNCVIMQSK-UHFFFAOYSA-N
XLogP1.96
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.66
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine?
The IUPAC name of (5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine (CID 91546324) is (5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine.
What is the SMILES notation for (5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine?
The canonical SMILES for (5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine is COc1cc2c(cc1Cl)CCC2=NN.
What is the InChIKey of (5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine?
The InChIKey is XAKFQYNCVIMQSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O/c1-14-10-5-7-6(4-8(10)11)2-3-9(7)13-12/h4-5H,2-3,12H2,1H3.
What are the key properties of (5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine?
(5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine has a molecular weight of 210.66 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-6-methoxy-2,3-dihydroinden-1-ylidene)hydrazine is sourced from PubChem (CID 91546324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).