5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine

C14H14N4O — CID 11543384

IUPAC5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine
SMILESCOc1ccc2c(-c3cnc(N)[nH]3)cc(C)nc2c1
InChIInChI=1S/C14H14N4O/c1-8-5-11(13-7-16-14(15)18-13)10-4-3-9(19-2)6-12(10)17-8/h3-7H,1-2H3,(H3,15,16,18)
InChIKeyFJZDFEQJILUENA-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.52
Rot. Bonds2

About 5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine

5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine (PubChem CID 11543384) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine
PubChem CID11543384
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine
SMILESCOc1ccc2c(-c3cnc(N)[nH]3)cc(C)nc2c1
InChIInChI=1S/C14H14N4O/c1-8-5-11(13-7-16-14(15)18-13)10-4-3-9(19-2)6-12(10)17-8/h3-7H,1-2H3,(H3,15,16,18)
InChIKeyFJZDFEQJILUENA-UHFFFAOYSA-N
XLogP2.52
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine?
The IUPAC name of 5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine (CID 11543384) is 5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine.
What is the SMILES notation for 5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine?
The canonical SMILES for 5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine is COc1ccc2c(-c3cnc(N)[nH]3)cc(C)nc2c1.
What is the InChIKey of 5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine?
The InChIKey is FJZDFEQJILUENA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c1-8-5-11(13-7-16-14(15)18-13)10-4-3-9(19-2)6-12(10)17-8/h3-7H,1-2H3,(H3,15,16,18).
What are the key properties of 5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine?
5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine has a molecular weight of 254.29 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine is sourced from PubChem (CID 11543384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).