7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one

C19H20N4O2 — CID 90364302

IUPAC7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one
SMILESCc1cc2c(cc1-c1c(C)noc1C)ncc1c2[nH]c(=O)n1C(C)C
InChIInChI=1S/C19H20N4O2/c1-9(2)23-16-8-20-15-7-13(17-11(4)22-25-12(17)5)10(3)6-14(15)18(16)21-19(23)24/h6-9H,1-5H3,(H,21,24)
InChIKeyRJKGSUNBFNHYDG-UHFFFAOYSA-N
MW336.40 g/mol
LogP4.04
Rot. Bonds2

About 7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one

7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one (PubChem CID 90364302) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one
PubChem CID90364302
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one
SMILESCc1cc2c(cc1-c1c(C)noc1C)ncc1c2[nH]c(=O)n1C(C)C
InChIInChI=1S/C19H20N4O2/c1-9(2)23-16-8-20-15-7-13(17-11(4)22-25-12(17)5)10(3)6-14(15)18(16)21-19(23)24/h6-9H,1-5H3,(H,21,24)
InChIKeyRJKGSUNBFNHYDG-UHFFFAOYSA-N
XLogP4.04
TPSA76.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one
CID 151683371
7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-3-(2-methoxyethyl)-1-propan-2-ylimidazo[4,5-c]quinolin-2-one
CID 123985108
7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-1-(1-pyridin-2-ylethyl)-3H-imidazo[4,5-c]quinolin-2-one
CID 52934274
7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-1-(1-pyridin-2-ylethyl)-3H-imidazo[4,5-c]quinolin-2-one;dihydrochloride
CID 154701303
3-amino-5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-2-one
CID 126692116
4-[2-[(3,3-difluoroazetidin-1-yl)methyl]-1-[(2R)-1-(difluoromethoxy)propan-2-yl]-8-methylimidazo[4,5-c]quinolin-7-yl]-3,5-dimethyl-1,2-oxazole
CID 134169090
6-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(1-phenylethyl)-3H-imidazo[4,5-b]pyridin-2-one
CID 121375770
1-(cyclopropylmethyl)-7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-3H-imidazo[4,5-c]quinolin-2-one
CID 164609567
4-[[1-[(2S)-1-(difluoromethoxy)propan-2-yl]-7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methylimidazo[4,5-c]quinolin-2-yl]methyl]morpholine
CID 134169088
7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-1-(oxan-4-yl)-3H-imidazo[4,5-c]quinolin-2-one
CID 164623489
1-(cyclohexylmethyl)-7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-3H-imidazo[4,5-c]quinolin-2-one
CID 52935407
7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one
CID 52933810

Frequently Asked Questions

What is the IUPAC name of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one?
The IUPAC name of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one (CID 90364302) is 7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one is Cc1cc2c(cc1-c1c(C)noc1C)ncc1c2[nH]c(=O)n1C(C)C.
What is the InChIKey of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one?
The InChIKey is RJKGSUNBFNHYDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-9(2)23-16-8-20-15-7-13(17-11(4)22-25-12(17)5)10(3)6-14(15)18(16)21-19(23)24/h6-9H,1-5H3,(H,21,24).
What are the key properties of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one?
7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one has a molecular weight of 336.40 g/mol, XLogP of 4.04, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 90364302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).