N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide

C21H20N4O3 — CID 108747115

IUPACN-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide
SMILESCOc1cccc2c(C)cc(-n3nc(C)cc3NC(=O)c3ccc(C)o3)nc12
InChIInChI=1S/C21H20N4O3/c1-12-10-18(22-20-15(12)6-5-7-16(20)27-4)25-19(11-13(2)24-25)23-21(26)17-9-8-14(3)28-17/h5-11H,1-4H3,(H,23,26)
InChIKeyRCYJAYWJAZLXNT-UHFFFAOYSA-N
MW376.42 g/mol
LogP4.20
Rot. Bonds4

About N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide

N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide (PubChem CID 108747115) has the molecular formula C21H20N4O3 and a molecular weight of 376.42 g/mol. Its IUPAC name is N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide
PubChem CID108747115
Molecular FormulaC21H20N4O3
Molecular Weight376.42 g/mol
Exact Mass376.15
IUPAC NameN-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide
SMILESCOc1cccc2c(C)cc(-n3nc(C)cc3NC(=O)c3ccc(C)o3)nc12
InChIInChI=1S/C21H20N4O3/c1-12-10-18(22-20-15(12)6-5-7-16(20)27-4)25-19(11-13(2)24-25)23-21(26)17-9-8-14(3)28-17/h5-11H,1-4H3,(H,23,26)
InChIKeyRCYJAYWJAZLXNT-UHFFFAOYSA-N
XLogP4.20
TPSA82.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

methyl N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]carbamate
CID 108747073
5-methyl-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]furan-2-carboxamide
CID 108747229
methyl 4-[[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]amino]-4-oxobutanoate
CID 108747124
4-(4-chlorophenoxy)-N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]butanamide
CID 108769248
N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-2-(2-prop-2-enoxyphenoxy)acetamide
CID 108769239
2-(2,5-dichlorophenoxy)-N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]acetamide
CID 108769235
N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-4-methyl-2-oxo-3H-pyrido[1,2-a]pyrimidine-4-carboxamide
CID 108801057
N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-6-(4-methoxyphenyl)pyridazin-3-amine
CID 108779054
N-[2-(4,8-dimethylquinolin-2-yl)-5-methylpyrazol-3-yl]-4-(4-ethylphenoxy)butanamide
CID 108769710
N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-6-(4-methylphenyl)pyridazin-3-amine
CID 108779051
N-[2-(4,8-dimethylquinolin-2-yl)-5-methylpyrazol-3-yl]-2-(2-propan-2-ylphenoxy)propanamide
CID 108769696
2-(4-chloro-3-methylphenoxy)-N-[2-(4,8-dimethylquinolin-2-yl)-5-methylpyrazol-3-yl]acetamide
CID 108769694

Frequently Asked Questions

What is the IUPAC name of N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide?
The IUPAC name of N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide (CID 108747115) is N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide.
What is the SMILES notation for N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide?
The canonical SMILES for N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide is COc1cccc2c(C)cc(-n3nc(C)cc3NC(=O)c3ccc(C)o3)nc12.
What is the InChIKey of N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide?
The InChIKey is RCYJAYWJAZLXNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O3/c1-12-10-18(22-20-15(12)6-5-7-16(20)27-4)25-19(11-13(2)24-25)23-21(26)17-9-8-14(3)28-17/h5-11H,1-4H3,(H,23,26).
What are the key properties of N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide?
N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide has a molecular weight of 376.42 g/mol, XLogP of 4.20, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]-5-methylfuran-2-carboxamide is sourced from PubChem (CID 108747115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).