3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide

C18H18N4O2 — CID 95745014

IUPAC3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide
SMILESCOc1ccc2cc(NC(=O)c3cc(C4CC4)nn3C)cnc2c1
InChIInChI=1S/C18H18N4O2/c1-22-17(9-16(21-22)11-3-4-11)18(23)20-13-7-12-5-6-14(24-2)8-15(12)19-10-13/h5-11H,3-4H2,1-2H3,(H,20,23)
InChIKeyLSPCUWGGHDLJGA-UHFFFAOYSA-N
MW322.37 g/mol
LogP3.11
Rot. Bonds4

About 3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide

3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide (PubChem CID 95745014) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is 3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide.

Molecular Properties

Compound Name3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide
PubChem CID95745014
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Name3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide
SMILESCOc1ccc2cc(NC(=O)c3cc(C4CC4)nn3C)cnc2c1
InChIInChI=1S/C18H18N4O2/c1-22-17(9-16(21-22)11-3-4-11)18(23)20-13-7-12-5-6-14(24-2)8-15(12)19-10-13/h5-11H,3-4H2,1-2H3,(H,20,23)
InChIKeyLSPCUWGGHDLJGA-UHFFFAOYSA-N
XLogP3.11
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-3-carboxamide
CID 95744911
N-(4-cyclopropyl-6-methylpyrimidin-2-yl)-7-methoxyquinoline-3-carboxamide
CID 138051189
N-(7-methoxyquinolin-3-yl)-2,5-dimethylbenzamide
CID 95745195
N-(7-methoxyquinolin-3-yl)-4-phenylbenzamide
CID 95745146
3-cyclopropyl-N-(3-methoxyphenyl)-1-phenylpyrazole-5-carboxamide
CID 27167430
3-(1,5-dimethylpyrazol-4-yl)-N-(7-methoxyquinolin-3-yl)propanamide
CID 75358407
2-benzoyl-N-(7-methoxyquinolin-3-yl)benzamide
CID 54773922
3-cyclopropyl-N-[4-[(4-methoxyphenyl)carbamoyl]phenyl]-1-phenylpyrazole-5-carboxamide
CID 16557342
5-(4-chlorophenyl)-N-(7-methoxyquinolin-3-yl)-1,2-oxazole-3-carboxamide
CID 95744974
1-[(4-fluorophenoxy)methyl]-N-(7-methoxyquinolin-3-yl)pyrazole-3-carboxamide
CID 95744924
3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(7-methoxyquinolin-3-yl)benzamide
CID 95744908
N-(7-methoxyquinolin-3-yl)-4-phenylmethoxybenzamide
CID 95745112

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide?
The IUPAC name of 3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide (CID 95745014) is 3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide.
What is the SMILES notation for 3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide?
The canonical SMILES for 3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide is COc1ccc2cc(NC(=O)c3cc(C4CC4)nn3C)cnc2c1.
What is the InChIKey of 3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide?
The InChIKey is LSPCUWGGHDLJGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-22-17(9-16(21-22)11-3-4-11)18(23)20-13-7-12-5-6-14(24-2)8-15(12)19-10-13/h5-11H,3-4H2,1-2H3,(H,20,23).
What are the key properties of 3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide?
3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide has a molecular weight of 322.37 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide is sourced from PubChem (CID 95745014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).