6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one

C15H17N5O2 — CID 142478286

IUPAC6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one
SMILESCc1nnc(C(C)Nc2cc(=O)n(C)c3ccc(N)cc23)o1
InChIInChI=1S/C15H17N5O2/c1-8(15-19-18-9(2)22-15)17-12-7-14(21)20(3)13-5-4-10(16)6-11(12)13/h4-8,17H,16H2,1-3H3
InChIKeyKWGNFKWHOAEMLB-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.99
Rot. Bonds3

About 6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one

6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one (PubChem CID 142478286) has the molecular formula C15H17N5O2 and a molecular weight of 299.33 g/mol. Its IUPAC name is 6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one.

Molecular Properties

Compound Name6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one
PubChem CID142478286
Molecular FormulaC15H17N5O2
Molecular Weight299.33 g/mol
Exact Mass299.14
IUPAC Name6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one
SMILESCc1nnc(C(C)Nc2cc(=O)n(C)c3ccc(N)cc23)o1
InChIInChI=1S/C15H17N5O2/c1-8(15-19-18-9(2)22-15)17-12-7-14(21)20(3)13-5-4-10(16)6-11(12)13/h4-8,17H,16H2,1-3H3
InChIKeyKWGNFKWHOAEMLB-UHFFFAOYSA-N
XLogP1.99
TPSA98.97 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-[(6-amino-1-methyl-2-oxoquinolin-4-yl)amino]-N-cyclopentylpropanamide
CID 156571031
6-amino-4-(cyclopropylamino)-1-methylquinolin-2-one
CID 142478419
6-amino-4-(2-hydroxyethylamino)-1-methylquinolin-2-one
CID 142478323
6-amino-4-[(1-methoxy-2-methylpropan-2-yl)amino]-1-methylquinolin-2-one
CID 142478226
6-amino-4-[[(2R)-2-ethylcyclopropyl]amino]-1-methylquinolin-2-one
CID 142478285
1-methyl-4-[1-(5-methyl-1H-1,2,4-triazol-3-yl)ethylamino]-6-nitroquinolin-2-one
CID 156564927
4-[1-(5-cyclobutylpyrimidin-2-yl)ethylamino]-6-(hydroxyamino)-1-methylquinolin-2-one
CID 142478221
1-methyl-4-[1-(1H-1,2,4-triazol-5-yl)ethylamino]quinolin-2-one
CID 106282955
1-methyl-4-(5-methylhexan-2-ylamino)quinolin-2-one
CID 81244322
2-fluoro-1-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzene-1,4-diamine
CID 106387593
1,3-dimethyl-5-[1-[5-(2-methylpropyl)-1,3,4-oxadiazol-2-yl]ethylamino]benzimidazol-2-one
CID 71990918
ethyl 5-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]-1-benzothiophene-2-carboxylate
CID 56788797

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one?
The IUPAC name of 6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one (CID 142478286) is 6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one.
What is the SMILES notation for 6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one?
The canonical SMILES for 6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one is Cc1nnc(C(C)Nc2cc(=O)n(C)c3ccc(N)cc23)o1.
What is the InChIKey of 6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one?
The InChIKey is KWGNFKWHOAEMLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O2/c1-8(15-19-18-9(2)22-15)17-12-7-14(21)20(3)13-5-4-10(16)6-11(12)13/h4-8,17H,16H2,1-3H3.
What are the key properties of 6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one?
6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one has a molecular weight of 299.33 g/mol, XLogP of 1.99, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-methyl-4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethylamino]quinolin-2-one is sourced from PubChem (CID 142478286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).