N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide

C18H20N4O2 — CID 134709541

IUPACN-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide
SMILESCCc1c(C)nn(C)c1NC(=O)c1cc(OC)nc2ccccc12
InChIInChI=1S/C18H20N4O2/c1-5-12-11(2)21-22(3)17(12)20-18(23)14-10-16(24-4)19-15-9-7-6-8-13(14)15/h6-10H,5H2,1-4H3,(H,20,23)
InChIKeyCNTRRSQTXRDWGW-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.10
Rot. Bonds4

About N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide

N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide (PubChem CID 134709541) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide
PubChem CID134709541
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC NameN-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide
SMILESCCc1c(C)nn(C)c1NC(=O)c1cc(OC)nc2ccccc12
InChIInChI=1S/C18H20N4O2/c1-5-12-11(2)21-22(3)17(12)20-18(23)14-10-16(24-4)19-15-9-7-6-8-13(14)15/h6-10H,5H2,1-4H3,(H,20,23)
InChIKeyCNTRRSQTXRDWGW-UHFFFAOYSA-N
XLogP3.10
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-[1-[2-(4-methoxyphenyl)ethyl]-3,5-dimethylpyrazol-4-yl]quinoline-4-carboxamide
CID 118171866
N-[3,5-dimethyl-1-[[4-(trifluoromethoxy)phenyl]methyl]pyrazol-4-yl]-2-methoxyquinoline-4-carboxamide
CID 118171295
ethyl 1-methyl-5-[[2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carbonyl]amino]pyrazole-4-carboxylate
CID 19512858
N-[3,5-dimethyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazol-4-yl]-2-methoxyquinoline-4-carboxamide
CID 118171502
4-[(2-methoxyquinoline-4-carbonyl)amino]benzoate
CID 6954390
2-methoxy-N-[2-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]quinoline-4-carboxamide
CID 119063740
N-methyl-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide
CID 19512882
2-[2-(diethylamino)ethoxy]-N-(2,6-dimethylphenyl)quinoline-4-carboxamide
CID 28239
N-[1-(ethoxymethyl)pyrazol-4-yl]-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide
CID 19512896
2-(2-chlorophenyl)-N-(4-methoxy-6-methylpyrimidin-2-yl)quinoline-4-carboxamide
CID 166364697
N-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-methoxyquinoline-4-carboxamide
CID 74238706
N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-(N-methylsulfonylanilino)propanamide
CID 134702896

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide?
The IUPAC name of N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide (CID 134709541) is N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide.
What is the SMILES notation for N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide?
The canonical SMILES for N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide is CCc1c(C)nn(C)c1NC(=O)c1cc(OC)nc2ccccc12.
What is the InChIKey of N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide?
The InChIKey is CNTRRSQTXRDWGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c1-5-12-11(2)21-22(3)17(12)20-18(23)14-10-16(24-4)19-15-9-7-6-8-13(14)15/h6-10H,5H2,1-4H3,(H,20,23).
What are the key properties of N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide?
N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-1,3-dimethylpyrazol-5-yl)-2-methoxyquinoline-4-carboxamide is sourced from PubChem (CID 134709541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).