7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide

C15H14N4O2 — CID 155538467

IUPAC7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)Nc3cc(C)[nH]n3)cnc2c1
InChIInChI=1S/C15H14N4O2/c1-9-5-14(19-18-9)17-15(20)11-6-10-3-4-12(21-2)7-13(10)16-8-11/h3-8H,1-2H3,(H2,17,18,19,20)
InChIKeyBXWBGOLZOPBBPE-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.53
Rot. Bonds3

About 7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide

7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide (PubChem CID 155538467) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide
PubChem CID155538467
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)Nc3cc(C)[nH]n3)cnc2c1
InChIInChI=1S/C15H14N4O2/c1-9-5-14(19-18-9)17-15(20)11-6-10-3-4-12(21-2)7-13(10)16-8-11/h3-8H,1-2H3,(H2,17,18,19,20)
InChIKeyBXWBGOLZOPBBPE-UHFFFAOYSA-N
XLogP2.53
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide?
The IUPAC name of 7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide (CID 155538467) is 7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide.
What is the SMILES notation for 7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide?
The canonical SMILES for 7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide is COc1ccc2cc(C(=O)Nc3cc(C)[nH]n3)cnc2c1.
What is the InChIKey of 7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide?
The InChIKey is BXWBGOLZOPBBPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-9-5-14(19-18-9)17-15(20)11-6-10-3-4-12(21-2)7-13(10)16-8-11/h3-8H,1-2H3,(H2,17,18,19,20).
What are the key properties of 7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide?
7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 2.53, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinoline-3-carboxamide is sourced from PubChem (CID 155538467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).