2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol

C21H30N4O2 — CID 158878662

IUPAC2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol
SMILESCc1nc2c(c(C)c1O)CCCN2C.Cc1nc2c(c(C)c1O)CCN2C
InChIInChI=1S/C11H16N2O.C10H14N2O/c1-7-9-5-4-6-13(3)11(9)12-8(2)10(7)14;1-6-8-4-5-12(3)10(8)11-7(2)9(6)13/h14H,4-6H2,1-3H3;13H,4-5H2,1-3H3
InChIKeyJCTJSGITDWBSER-UHFFFAOYSA-N
MW370.50 g/mol
LogP3.18
Rot. Bonds

About 2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol

2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol (PubChem CID 158878662) has the molecular formula C21H30N4O2 and a molecular weight of 370.50 g/mol. Its IUPAC name is 2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol.

Molecular Properties

Compound Name2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol
PubChem CID158878662
Molecular FormulaC21H30N4O2
Molecular Weight370.50 g/mol
Exact Mass370.24
IUPAC Name2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol
SMILESCc1nc2c(c(C)c1O)CCCN2C.Cc1nc2c(c(C)c1O)CCN2C
InChIInChI=1S/C11H16N2O.C10H14N2O/c1-7-9-5-4-6-13(3)11(9)12-8(2)10(7)14;1-6-8-4-5-12(3)10(8)11-7(2)9(6)13/h14H,4-6H2,1-3H3;13H,4-5H2,1-3H3
InChIKeyJCTJSGITDWBSER-UHFFFAOYSA-N
XLogP3.18
TPSA72.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol?
The IUPAC name of 2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol (CID 158878662) is 2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol.
What is the SMILES notation for 2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol?
The canonical SMILES for 2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol is Cc1nc2c(c(C)c1O)CCCN2C.Cc1nc2c(c(C)c1O)CCN2C.
What is the InChIKey of 2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol?
The InChIKey is JCTJSGITDWBSER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O.C10H14N2O/c1-7-9-5-4-6-13(3)11(9)12-8(2)10(7)14;1-6-8-4-5-12(3)10(8)11-7(2)9(6)13/h14H,4-6H2,1-3H3;13H,4-5H2,1-3H3.
What are the key properties of 2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol?
2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol has a molecular weight of 370.50 g/mol, XLogP of 3.18, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,8-trimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol;1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol is sourced from PubChem (CID 158878662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).