6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride

C16H13ClN2 — CID 88612038

IUPAC6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride
SMILESC1=c2ccccc2=C2C=c3ncccc3=CN2C1.Cl
InChIInChI=1S/C16H12N2.ClH/c1-2-6-14-12(4-1)7-9-18-11-13-5-3-8-17-15(13)10-16(14)18;/h1-8,10-11H,9H2;1H
InChIKeyBLQIXLSOSDTIFZ-UHFFFAOYSA-N
MW268.75 g/mol
LogP-0.06
Rot. Bonds

About 6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride

6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride (PubChem CID 88612038) has the molecular formula C16H13ClN2 and a molecular weight of 268.75 g/mol. Its IUPAC name is 6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride.

Molecular Properties

Compound Name6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride
PubChem CID88612038
Molecular FormulaC16H13ClN2
Molecular Weight268.75 g/mol
Exact Mass268.08
IUPAC Name6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride
SMILESC1=c2ccccc2=C2C=c3ncccc3=CN2C1.Cl
InChIInChI=1S/C16H12N2.ClH/c1-2-6-14-12(4-1)7-9-18-11-13-5-3-8-17-15(13)10-16(14)18;/h1-8,10-11H,9H2;1H
InChIKeyBLQIXLSOSDTIFZ-UHFFFAOYSA-N
XLogP-0.06
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.75
LogP ≤ 5-0.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 13602417
CID 13602417
CID 18921534
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CID 19067743
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CID 57207223
CID 57207223
CID 57315050
CID 57315050
CID 85972581
CID 85972581
CID 87786174
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CID 87883428
CID 87883428

Frequently Asked Questions

What is the IUPAC name of 6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride?
The IUPAC name of 6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride (CID 88612038) is 6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride.
What is the SMILES notation for 6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride?
The canonical SMILES for 6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride is C1=c2ccccc2=C2C=c3ncccc3=CN2C1.Cl.
What is the InChIKey of 6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride?
The InChIKey is BLQIXLSOSDTIFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2.ClH/c1-2-6-14-12(4-1)7-9-18-11-13-5-3-8-17-15(13)10-16(14)18;/h1-8,10-11H,9H2;1H.
What are the key properties of 6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride?
6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride has a molecular weight of 268.75 g/mol, XLogP of -0.06, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6H-isoquinolino[2,1-g][1,6]naphthyridine;hydrochloride is sourced from PubChem (CID 88612038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).