6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one

C14H16N4O — CID 82482606

IUPAC6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one
SMILESCc1[nH]c(N)nc1-c1ccc2c(c1)CCC(=O)N2C
InChIInChI=1S/C14H16N4O/c1-8-13(17-14(15)16-8)10-3-5-11-9(7-10)4-6-12(19)18(11)2/h3,5,7H,4,6H2,1-2H3,(H3,15,16,17)
InChIKeyNPSKHVCBANVQBQ-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.88
Rot. Bonds1

About 6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one

6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one (PubChem CID 82482606) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is 6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one
PubChem CID82482606
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC Name6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one
SMILESCc1[nH]c(N)nc1-c1ccc2c(c1)CCC(=O)N2C
InChIInChI=1S/C14H16N4O/c1-8-13(17-14(15)16-8)10-3-5-11-9(7-10)4-6-12(19)18(11)2/h3,5,7H,4,6H2,1-2H3,(H3,15,16,17)
InChIKeyNPSKHVCBANVQBQ-UHFFFAOYSA-N
XLogP1.88
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one?
The IUPAC name of 6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one (CID 82482606) is 6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one?
The canonical SMILES for 6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one is Cc1[nH]c(N)nc1-c1ccc2c(c1)CCC(=O)N2C.
What is the InChIKey of 6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one?
The InChIKey is NPSKHVCBANVQBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-8-13(17-14(15)16-8)10-3-5-11-9(7-10)4-6-12(19)18(11)2/h3,5,7H,4,6H2,1-2H3,(H3,15,16,17).
What are the key properties of 6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one?
6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one has a molecular weight of 256.31 g/mol, XLogP of 1.88, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-amino-5-methyl-1H-imidazol-4-yl)-1-methyl-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 82482606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).