2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol

C24H26N2O2 — CID 171633424

IUPAC2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol
SMILESCc1c(COc2ccc3c(n2)CCN(CCO)C3)cccc1-c1ccccc1
InChIInChI=1S/C24H26N2O2/c1-18-21(8-5-9-22(18)19-6-3-2-4-7-19)17-28-24-11-10-20-16-26(14-15-27)13-12-23(20)25-24/h2-11,27H,12-17H2,1H3
InChIKeyAIDXJUAWTKCDMT-UHFFFAOYSA-N
MW374.48 g/mol
LogP3.99
Rot. Bonds6

About 2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol

2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol (PubChem CID 171633424) has the molecular formula C24H26N2O2 and a molecular weight of 374.48 g/mol. Its IUPAC name is 2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol.

Molecular Properties

Compound Name2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol
PubChem CID171633424
Molecular FormulaC24H26N2O2
Molecular Weight374.48 g/mol
Exact Mass374.20
IUPAC Name2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol
SMILESCc1c(COc2ccc3c(n2)CCN(CCO)C3)cccc1-c1ccccc1
InChIInChI=1S/C24H26N2O2/c1-18-21(8-5-9-22(18)19-6-3-2-4-7-19)17-28-24-11-10-20-16-26(14-15-27)13-12-23(20)25-24/h2-11,27H,12-17H2,1H3
InChIKeyAIDXJUAWTKCDMT-UHFFFAOYSA-N
XLogP3.99
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.48
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol?
The IUPAC name of 2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol (CID 171633424) is 2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol.
What is the SMILES notation for 2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol?
The canonical SMILES for 2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol is Cc1c(COc2ccc3c(n2)CCN(CCO)C3)cccc1-c1ccccc1.
What is the InChIKey of 2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol?
The InChIKey is AIDXJUAWTKCDMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O2/c1-18-21(8-5-9-22(18)19-6-3-2-4-7-19)17-28-24-11-10-20-16-26(14-15-27)13-12-23(20)25-24/h2-11,27H,12-17H2,1H3.
What are the key properties of 2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol?
2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol has a molecular weight of 374.48 g/mol, XLogP of 3.99, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2-methyl-3-phenylphenyl)methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanol is sourced from PubChem (CID 171633424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).