1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one

C14H19N3O2 — CID 90654324

IUPAC1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one
SMILESCOc1cc(C)c2ccc(=O)n(CCN(C)C)c2n1
InChIInChI=1S/C14H19N3O2/c1-10-9-12(19-4)15-14-11(10)5-6-13(18)17(14)8-7-16(2)3/h5-6,9H,7-8H2,1-4H3
InChIKeyBQUBZZUYARDRHO-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.28
Rot. Bonds4

About 1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one

1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one (PubChem CID 90654324) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one
PubChem CID90654324
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one
SMILESCOc1cc(C)c2ccc(=O)n(CCN(C)C)c2n1
InChIInChI=1S/C14H19N3O2/c1-10-9-12(19-4)15-14-11(10)5-6-13(18)17(14)8-7-16(2)3/h5-6,9H,7-8H2,1-4H3
InChIKeyBQUBZZUYARDRHO-UHFFFAOYSA-N
XLogP1.28
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one (CID 90654324) is 1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one is COc1cc(C)c2ccc(=O)n(CCN(C)C)c2n1.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one?
The InChIKey is BQUBZZUYARDRHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-10-9-12(19-4)15-14-11(10)5-6-13(18)17(14)8-7-16(2)3/h5-6,9H,7-8H2,1-4H3.
What are the key properties of 1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one?
1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one has a molecular weight of 261.32 g/mol, XLogP of 1.28, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-7-methoxy-5-methyl-1,8-naphthyridin-2-one is sourced from PubChem (CID 90654324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).