2-methyl-4-(propylamino)quinolin-8-ol

C13H16N2O — CID 45097479

IUPAC2-methyl-4-(propylamino)quinolin-8-ol
SMILESCCCNc1cc(C)nc2c(O)cccc12
InChIInChI=1S/C13H16N2O/c1-3-7-14-11-8-9(2)15-13-10(11)5-4-6-12(13)16/h4-6,8,16H,3,7H2,1-2H3,(H,14,15)
InChIKeyKYHAADBLNAGYNN-UHFFFAOYSA-N
MW216.28 g/mol
LogP3.07
Rot. Bonds3

About 2-methyl-4-(propylamino)quinolin-8-ol

2-methyl-4-(propylamino)quinolin-8-ol (PubChem CID 45097479) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-methyl-4-(propylamino)quinolin-8-ol.

Molecular Properties

Compound Name2-methyl-4-(propylamino)quinolin-8-ol
PubChem CID45097479
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name2-methyl-4-(propylamino)quinolin-8-ol
SMILESCCCNc1cc(C)nc2c(O)cccc12
InChIInChI=1S/C13H16N2O/c1-3-7-14-11-8-9(2)15-13-10(11)5-4-6-12(13)16/h4-6,8,16H,3,7H2,1-2H3,(H,14,15)
InChIKeyKYHAADBLNAGYNN-UHFFFAOYSA-N
XLogP3.07
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(propylamino)quinolin-8-ol?
The IUPAC name of 2-methyl-4-(propylamino)quinolin-8-ol (CID 45097479) is 2-methyl-4-(propylamino)quinolin-8-ol.
What is the SMILES notation for 2-methyl-4-(propylamino)quinolin-8-ol?
The canonical SMILES for 2-methyl-4-(propylamino)quinolin-8-ol is CCCNc1cc(C)nc2c(O)cccc12.
What is the InChIKey of 2-methyl-4-(propylamino)quinolin-8-ol?
The InChIKey is KYHAADBLNAGYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-3-7-14-11-8-9(2)15-13-10(11)5-4-6-12(13)16/h4-6,8,16H,3,7H2,1-2H3,(H,14,15).
What are the key properties of 2-methyl-4-(propylamino)quinolin-8-ol?
2-methyl-4-(propylamino)quinolin-8-ol has a molecular weight of 216.28 g/mol, XLogP of 3.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(propylamino)quinolin-8-ol is sourced from PubChem (CID 45097479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).