[8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol

C19H16N2O2 — CID 129028012

IUPAC[8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol
SMILESCc1c(-c2cc(CO)c3cncc(C)c3n2)oc2ccccc12
InChIInChI=1S/C19H16N2O2/c1-11-8-20-9-15-13(10-22)7-16(21-18(11)15)19-12(2)14-5-3-4-6-17(14)23-19/h3-9,22H,10H2,1-2H3
InChIKeySSOPIUDNGDETTJ-UHFFFAOYSA-N
MW304.35 g/mol
LogP4.15
Rot. Bonds2

About [8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol

[8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol (PubChem CID 129028012) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is [8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol.

Molecular Properties

Compound Name[8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol
PubChem CID129028012
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name[8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol
SMILESCc1c(-c2cc(CO)c3cncc(C)c3n2)oc2ccccc12
InChIInChI=1S/C19H16N2O2/c1-11-8-20-9-15-13(10-22)7-16(21-18(11)15)19-12(2)14-5-3-4-6-17(14)23-19/h3-9,22H,10H2,1-2H3
InChIKeySSOPIUDNGDETTJ-UHFFFAOYSA-N
XLogP4.15
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol?
The IUPAC name of [8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol (CID 129028012) is [8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol.
What is the SMILES notation for [8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol?
The canonical SMILES for [8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol is Cc1c(-c2cc(CO)c3cncc(C)c3n2)oc2ccccc12.
What is the InChIKey of [8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol?
The InChIKey is SSOPIUDNGDETTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-11-8-20-9-15-13(10-22)7-16(21-18(11)15)19-12(2)14-5-3-4-6-17(14)23-19/h3-9,22H,10H2,1-2H3.
What are the key properties of [8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol?
[8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol has a molecular weight of 304.35 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [8-methyl-2-(3-methyl-1-benzofuran-2-yl)-1,6-naphthyridin-4-yl]methanol is sourced from PubChem (CID 129028012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).