4-[(4-pyrazol-1-ylphenyl)methyl]quinoline

C19H15N3 — CID 174923169

IUPAC4-[(4-pyrazol-1-ylphenyl)methyl]quinoline
SMILESc1ccc2c(Cc3ccc(-n4cccn4)cc3)ccnc2c1
InChIInChI=1S/C19H15N3/c1-2-5-19-18(4-1)16(10-12-20-19)14-15-6-8-17(9-7-15)22-13-3-11-21-22/h1-13H,14H2
InChIKeyVZQZPBDAJSQZCB-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.01
Rot. Bonds3

About 4-[(4-pyrazol-1-ylphenyl)methyl]quinoline

4-[(4-pyrazol-1-ylphenyl)methyl]quinoline (PubChem CID 174923169) has the molecular formula C19H15N3 and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-[(4-pyrazol-1-ylphenyl)methyl]quinoline.

Molecular Properties

Compound Name4-[(4-pyrazol-1-ylphenyl)methyl]quinoline
PubChem CID174923169
Molecular FormulaC19H15N3
Molecular Weight285.35 g/mol
Exact Mass285.13
IUPAC Name4-[(4-pyrazol-1-ylphenyl)methyl]quinoline
SMILESc1ccc2c(Cc3ccc(-n4cccn4)cc3)ccnc2c1
InChIInChI=1S/C19H15N3/c1-2-5-19-18(4-1)16(10-12-20-19)14-15-6-8-17(9-7-15)22-13-3-11-21-22/h1-13H,14H2
InChIKeyVZQZPBDAJSQZCB-UHFFFAOYSA-N
XLogP4.01
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(quinolin-4-ylmethyl)phenol
CID 83128983
1,1'-biphenyl;4-[(4-methylphenyl)methyl]quinoline
CID 160837559
7-[4-(quinolin-4-ylmethyl)phenyl]heptanoic acid
CID 15667429
6-chloro-4-[(4-pyrazol-1-ylphenyl)methyl]pyridin-3-ol
CID 125491841
4-(4-pyrazol-1-ylphenoxy)quinazoline
CID 138038739
1-(3-benzyl-4-methylphenyl)pyrazole
CID 58508496
7-[(4-pyrazol-1-ylphenyl)methyl]furo[3,2-b]pyridine-5-carboxylic acid
CID 142503654
1-[4-[10-(4-pyrazol-1-ylphenyl)anthracen-9-yl]phenyl]pyrazole
CID 142384034
4-(pyrrol-1-ylmethyl)quinoline
CID 79240222
N-methyl-2-[2-(4-pyrazol-1-ylphenyl)ethyl]aniline
CID 145122965
6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine
CID 145270329
1-(4-prop-2-enylphenyl)pyrazole
CID 90761128

Frequently Asked Questions

What is the IUPAC name of 4-[(4-pyrazol-1-ylphenyl)methyl]quinoline?
The IUPAC name of 4-[(4-pyrazol-1-ylphenyl)methyl]quinoline (CID 174923169) is 4-[(4-pyrazol-1-ylphenyl)methyl]quinoline.
What is the SMILES notation for 4-[(4-pyrazol-1-ylphenyl)methyl]quinoline?
The canonical SMILES for 4-[(4-pyrazol-1-ylphenyl)methyl]quinoline is c1ccc2c(Cc3ccc(-n4cccn4)cc3)ccnc2c1.
What is the InChIKey of 4-[(4-pyrazol-1-ylphenyl)methyl]quinoline?
The InChIKey is VZQZPBDAJSQZCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3/c1-2-5-19-18(4-1)16(10-12-20-19)14-15-6-8-17(9-7-15)22-13-3-11-21-22/h1-13H,14H2.
What are the key properties of 4-[(4-pyrazol-1-ylphenyl)methyl]quinoline?
4-[(4-pyrazol-1-ylphenyl)methyl]quinoline has a molecular weight of 285.35 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-pyrazol-1-ylphenyl)methyl]quinoline is sourced from PubChem (CID 174923169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).