2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine

C21H24ClN5 — CID 21445472

IUPAC2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine
SMILESCCN(CC)CCn1c2ccc(Cl)cc2c2c3ccccc3nc(NN)c21
InChIInChI=1S/C21H24ClN5/c1-3-26(4-2)11-12-27-18-10-9-14(22)13-16(18)19-15-7-5-6-8-17(15)24-21(25-23)20(19)27/h5-10,13H,3-4,11-12,23H2,1-2H3,(H,24,25)
InChIKeyURWFDJGGIKJXDT-UHFFFAOYSA-N
MW381.91 g/mol
LogP4.62
Rot. Bonds6

About 2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine

2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine (PubChem CID 21445472) has the molecular formula C21H24ClN5 and a molecular weight of 381.91 g/mol. Its IUPAC name is 2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine.

Molecular Properties

Compound Name2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine
PubChem CID21445472
Molecular FormulaC21H24ClN5
Molecular Weight381.91 g/mol
Exact Mass381.17
IUPAC Name2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine
SMILESCCN(CC)CCn1c2ccc(Cl)cc2c2c3ccccc3nc(NN)c21
InChIInChI=1S/C21H24ClN5/c1-3-26(4-2)11-12-27-18-10-9-14(22)13-16(18)19-15-7-5-6-8-17(15)24-21(25-23)20(19)27/h5-10,13H,3-4,11-12,23H2,1-2H3,(H,24,25)
InChIKeyURWFDJGGIKJXDT-UHFFFAOYSA-N
XLogP4.62
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.91
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine?
The IUPAC name of 2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine (CID 21445472) is 2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine.
What is the SMILES notation for 2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine?
The canonical SMILES for 2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine is CCN(CC)CCn1c2ccc(Cl)cc2c2c3ccccc3nc(NN)c21.
What is the InChIKey of 2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine?
The InChIKey is URWFDJGGIKJXDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24ClN5/c1-3-26(4-2)11-12-27-18-10-9-14(22)13-16(18)19-15-7-5-6-8-17(15)24-21(25-23)20(19)27/h5-10,13H,3-4,11-12,23H2,1-2H3,(H,24,25).
What are the key properties of 2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine?
2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine has a molecular weight of 381.91 g/mol, XLogP of 4.62, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(10-chloro-6-hydrazinylindolo[2,3-c]quinolin-7-yl)-N,N-diethylethanamine is sourced from PubChem (CID 21445472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).