1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine

C16H12N4O — CID 118577056

IUPAC1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine
SMILESCOc1nccc2cnc(-n3ccc4ccncc43)cc12
InChIInChI=1S/C16H12N4O/c1-21-16-13-8-15(19-9-12(13)3-6-18-16)20-7-4-11-2-5-17-10-14(11)20/h2-10H,1H3
InChIKeyGJBFNSCALNZCOT-UHFFFAOYSA-N
MW276.30 g/mol
LogP2.98
Rot. Bonds2

About 1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine

1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine (PubChem CID 118577056) has the molecular formula C16H12N4O and a molecular weight of 276.30 g/mol. Its IUPAC name is 1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine.

Molecular Properties

Compound Name1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine
PubChem CID118577056
Molecular FormulaC16H12N4O
Molecular Weight276.30 g/mol
Exact Mass276.10
IUPAC Name1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine
SMILESCOc1nccc2cnc(-n3ccc4ccncc43)cc12
InChIInChI=1S/C16H12N4O/c1-21-16-13-8-15(19-9-12(13)3-6-18-16)20-7-4-11-2-5-17-10-14(11)20/h2-10H,1H3
InChIKeyGJBFNSCALNZCOT-UHFFFAOYSA-N
XLogP2.98
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.30
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine?
The IUPAC name of 1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine (CID 118577056) is 1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine.
What is the SMILES notation for 1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine?
The canonical SMILES for 1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine is COc1nccc2cnc(-n3ccc4ccncc43)cc12.
What is the InChIKey of 1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine?
The InChIKey is GJBFNSCALNZCOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4O/c1-21-16-13-8-15(19-9-12(13)3-6-18-16)20-7-4-11-2-5-17-10-14(11)20/h2-10H,1H3.
What are the key properties of 1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine?
1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine has a molecular weight of 276.30 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine is sourced from PubChem (CID 118577056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).