4-(1H-indazol-5-yl)quinoline

C16H11N3 — CID 139407455

IUPAC4-(1H-indazol-5-yl)quinoline
SMILESc1ccc2c(-c3ccc4[nH]ncc4c3)ccnc2c1
InChIInChI=1S/C16H11N3/c1-2-4-16-14(3-1)13(7-8-17-16)11-5-6-15-12(9-11)10-18-19-15/h1-10H,(H,18,19)
InChIKeyVYDFXXNOXXBKRR-UHFFFAOYSA-N
MW245.29 g/mol
LogP3.78
Rot. Bonds1

About 4-(1H-indazol-5-yl)quinoline

4-(1H-indazol-5-yl)quinoline (PubChem CID 139407455) has the molecular formula C16H11N3 and a molecular weight of 245.29 g/mol. Its IUPAC name is 4-(1H-indazol-5-yl)quinoline.

Molecular Properties

Compound Name4-(1H-indazol-5-yl)quinoline
PubChem CID139407455
Molecular FormulaC16H11N3
Molecular Weight245.29 g/mol
Exact Mass245.10
IUPAC Name4-(1H-indazol-5-yl)quinoline
SMILESc1ccc2c(-c3ccc4[nH]ncc4c3)ccnc2c1
InChIInChI=1S/C16H11N3/c1-2-4-16-14(3-1)13(7-8-17-16)11-5-6-15-12(9-11)10-18-19-15/h1-10H,(H,18,19)
InChIKeyVYDFXXNOXXBKRR-UHFFFAOYSA-N
XLogP3.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-naphthalen-2-ylquinoline
CID 14173372
[2-(1H-indazol-5-yl)phenyl]methanol
CID 56711805
7-quinolin-4-yl-1H-quinolin-2-one
CID 175792512
5-(2-methyl-4-pyridinyl)-1H-indazole
CID 143158050
N,N-dimethyl-4-(5-quinolin-4-yl-1H-indol-2-yl)pyridin-2-amine
CID 146451930
4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]quinoline
CID 22352423
4-[4-(2,6-dinaphthalen-2-yl-4-pyridinyl)phenyl]quinoline
CID 122427626
4-(3-fluorophenyl)quinoline
CID 141309372
4-(3-methylphenyl)quinoline
CID 146587179
4-(1H-indazol-5-yl)pyrimidin-2-amine
CID 54420708
1H-indazole;quinoline
CID 67837536
4-[3-(2-phenylethyl)-2H-indazol-5-yl]quinoline
CID 20580711

Frequently Asked Questions

What is the IUPAC name of 4-(1H-indazol-5-yl)quinoline?
The IUPAC name of 4-(1H-indazol-5-yl)quinoline (CID 139407455) is 4-(1H-indazol-5-yl)quinoline.
What is the SMILES notation for 4-(1H-indazol-5-yl)quinoline?
The canonical SMILES for 4-(1H-indazol-5-yl)quinoline is c1ccc2c(-c3ccc4[nH]ncc4c3)ccnc2c1.
What is the InChIKey of 4-(1H-indazol-5-yl)quinoline?
The InChIKey is VYDFXXNOXXBKRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3/c1-2-4-16-14(3-1)13(7-8-17-16)11-5-6-15-12(9-11)10-18-19-15/h1-10H,(H,18,19).
What are the key properties of 4-(1H-indazol-5-yl)quinoline?
4-(1H-indazol-5-yl)quinoline has a molecular weight of 245.29 g/mol, XLogP of 3.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-indazol-5-yl)quinoline is sourced from PubChem (CID 139407455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).