8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol

C14H22N2O — CID 71528059

IUPAC8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol
SMILESCCCCN1CCCc2c1nc(C)c(O)c2C
InChIInChI=1S/C14H22N2O/c1-4-5-8-16-9-6-7-12-10(2)13(17)11(3)15-14(12)16/h17H,4-9H2,1-3H3
InChIKeyOWGIQUBJYHWOGU-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.96
Rot. Bonds3

About 8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol

8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol (PubChem CID 71528059) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol.

Molecular Properties

Compound Name8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol
PubChem CID71528059
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol
SMILESCCCCN1CCCc2c1nc(C)c(O)c2C
InChIInChI=1S/C14H22N2O/c1-4-5-8-16-9-6-7-12-10(2)13(17)11(3)15-14(12)16/h17H,4-9H2,1-3H3
InChIKeyOWGIQUBJYHWOGU-UHFFFAOYSA-N
XLogP2.96
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol?
The IUPAC name of 8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol (CID 71528059) is 8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol.
What is the SMILES notation for 8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol?
The canonical SMILES for 8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol is CCCCN1CCCc2c1nc(C)c(O)c2C.
What is the InChIKey of 8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol?
The InChIKey is OWGIQUBJYHWOGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-5-8-16-9-6-7-12-10(2)13(17)11(3)15-14(12)16/h17H,4-9H2,1-3H3.
What are the key properties of 8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol?
8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol has a molecular weight of 234.34 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-butyl-2,4-dimethyl-6,7-dihydro-5H-1,8-naphthyridin-3-ol is sourced from PubChem (CID 71528059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).