7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide

C17H18N4O2 — CID 46982682

IUPAC7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide
SMILESCOc1ccc2c(C(=O)N(C)C)cc(-c3cnn(C)c3)nc2c1
InChIInChI=1S/C17H18N4O2/c1-20(2)17(22)14-8-15(11-9-18-21(3)10-11)19-16-7-12(23-4)5-6-13(14)16/h5-10H,1-4H3
InChIKeyMGNJGDIGNRNFNU-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.35
Rot. Bonds3

About 7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide

7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide (PubChem CID 46982682) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is 7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide.

Molecular Properties

Compound Name7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide
PubChem CID46982682
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC Name7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide
SMILESCOc1ccc2c(C(=O)N(C)C)cc(-c3cnn(C)c3)nc2c1
InChIInChI=1S/C17H18N4O2/c1-20(2)17(22)14-8-15(11-9-18-21(3)10-11)19-16-7-12(23-4)5-6-13(14)16/h5-10H,1-4H3
InChIKeyMGNJGDIGNRNFNU-UHFFFAOYSA-N
XLogP2.35
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

7-methoxy-N-methyl-2-(1-methylpyrazol-4-yl)-N-(2-pyridin-2-ylethyl)quinoline-4-carboxamide
CID 46998816
[7-methoxy-2-(1-propylpyrazol-4-yl)quinolin-4-yl]-(2-methylpyrrolidin-1-yl)methanone
CID 45209543
6-(3-methoxyphenyl)-N,N,1-trimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 134803311
2-(1-methylpyrazol-4-yl)quinoline-4-carboxylate
CID 7017781
N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide
CID 19518443
2-(1-methylpyrazol-4-yl)-N-propan-2-ylquinoline-4-carboxamide
CID 19513034
aminothiourea;methyl 2-(1-methylpyrazol-4-yl)quinoline-4-carboxylate
CID 90741884
2-(1-methylpyrazol-4-yl)-N-[(1-methylpyrazol-4-yl)methyl]quinoline-4-carboxamide
CID 19513012
2-(1-methylpyrazol-4-yl)-N-propylquinoline-4-carboxamide
CID 19513031
4-(4-methoxyphenyl)-1-methylpyrazole
CID 4101323
N,N-dimethyl-2-[1-[(3-methylphenyl)methyl]pyrazol-4-yl]quinoline-4-carboxamide
CID 39776190
7-methoxy-2-[4-(trifluoromethoxy)phenyl]quinoline-4-carboxylic acid
CID 18073526

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide?
The IUPAC name of 7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide (CID 46982682) is 7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide.
What is the SMILES notation for 7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide?
The canonical SMILES for 7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide is COc1ccc2c(C(=O)N(C)C)cc(-c3cnn(C)c3)nc2c1.
What is the InChIKey of 7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide?
The InChIKey is MGNJGDIGNRNFNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-20(2)17(22)14-8-15(11-9-18-21(3)10-11)19-16-7-12(23-4)5-6-13(14)16/h5-10H,1-4H3.
What are the key properties of 7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide?
7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide has a molecular weight of 310.36 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N,N-dimethyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide is sourced from PubChem (CID 46982682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).