N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine

C21H24N4 — CID 46228542

IUPACN'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine
SMILESNCCCCCCNc1nc2ccccc2c2[nH]c3ccccc3c12
InChIInChI=1S/C21H24N4/c22-13-7-1-2-8-14-23-21-19-15-9-3-5-11-17(15)24-20(19)16-10-4-6-12-18(16)25-21/h3-6,9-12,24H,1-2,7-8,13-14,22H2,(H,23,25)
InChIKeyYEOWHNOFSNSXHU-UHFFFAOYSA-N
MW332.45 g/mol
LogP4.80
Rot. Bonds7

About N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine

N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine (PubChem CID 46228542) has the molecular formula C21H24N4 and a molecular weight of 332.45 g/mol. Its IUPAC name is N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine.

Molecular Properties

Compound NameN'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine
PubChem CID46228542
Molecular FormulaC21H24N4
Molecular Weight332.45 g/mol
Exact Mass332.20
IUPAC NameN'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine
SMILESNCCCCCCNc1nc2ccccc2c2[nH]c3ccccc3c12
InChIInChI=1S/C21H24N4/c22-13-7-1-2-8-14-23-21-19-15-9-3-5-11-17(15)24-20(19)16-10-4-6-12-18(16)25-21/h3-6,9-12,24H,1-2,7-8,13-14,22H2,(H,23,25)
InChIKeyYEOWHNOFSNSXHU-UHFFFAOYSA-N
XLogP4.80
TPSA66.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 54.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine?
The IUPAC name of N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine (CID 46228542) is N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine.
What is the SMILES notation for N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine?
The canonical SMILES for N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine is NCCCCCCNc1nc2ccccc2c2[nH]c3ccccc3c12.
What is the InChIKey of N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine?
The InChIKey is YEOWHNOFSNSXHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4/c22-13-7-1-2-8-14-23-21-19-15-9-3-5-11-17(15)24-20(19)16-10-4-6-12-18(16)25-21/h3-6,9-12,24H,1-2,7-8,13-14,22H2,(H,23,25).
What are the key properties of N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine?
N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine has a molecular weight of 332.45 g/mol, XLogP of 4.80, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(11H-indolo[3,2-c]quinolin-6-yl)hexane-1,6-diamine is sourced from PubChem (CID 46228542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).