(2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone

C20H24N2O2 — CID 91917832

IUPAC(2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone
SMILESCCOc1ccc2c(n1)CCN(C(=O)c1ccc(C(C)C)cc1)C2
InChIInChI=1S/C20H24N2O2/c1-4-24-19-10-9-17-13-22(12-11-18(17)21-19)20(23)16-7-5-15(6-8-16)14(2)3/h5-10,14H,4,11-13H2,1-3H3
InChIKeyPAWSGOWFKAPWIQ-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.80
Rot. Bonds4

About (2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone

(2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone (PubChem CID 91917832) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is (2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone.

Molecular Properties

Compound Name(2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone
PubChem CID91917832
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name(2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone
SMILESCCOc1ccc2c(n1)CCN(C(=O)c1ccc(C(C)C)cc1)C2
InChIInChI=1S/C20H24N2O2/c1-4-24-19-10-9-17-13-22(12-11-18(17)21-19)20(23)16-7-5-15(6-8-16)14(2)3/h5-10,14H,4,11-13H2,1-3H3
InChIKeyPAWSGOWFKAPWIQ-UHFFFAOYSA-N
XLogP3.80
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone?
The IUPAC name of (2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone (CID 91917832) is (2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone.
What is the SMILES notation for (2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone?
The canonical SMILES for (2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone is CCOc1ccc2c(n1)CCN(C(=O)c1ccc(C(C)C)cc1)C2.
What is the InChIKey of (2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone?
The InChIKey is PAWSGOWFKAPWIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-4-24-19-10-9-17-13-22(12-11-18(17)21-19)20(23)16-7-5-15(6-8-16)14(2)3/h5-10,14H,4,11-13H2,1-3H3.
What are the key properties of (2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone?
(2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone has a molecular weight of 324.42 g/mol, XLogP of 3.80, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxy-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-(4-propan-2-ylphenyl)methanone is sourced from PubChem (CID 91917832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).