1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine

C16H18N4 — CID 105159324

IUPAC1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine
SMILESCc1cc(C(N)Cc2ccnc3ccccc23)n(C)n1
InChIInChI=1S/C16H18N4/c1-11-9-16(20(2)19-11)14(17)10-12-7-8-18-15-6-4-3-5-13(12)15/h3-9,14H,10,17H2,1-2H3
InChIKeyFDKPFQDGKKZTNS-UHFFFAOYSA-N
MW266.35 g/mol
LogP2.52
Rot. Bonds3

About 1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine

1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine (PubChem CID 105159324) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine.

Molecular Properties

Compound Name1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine
PubChem CID105159324
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine
SMILESCc1cc(C(N)Cc2ccnc3ccccc23)n(C)n1
InChIInChI=1S/C16H18N4/c1-11-9-16(20(2)19-11)14(17)10-12-7-8-18-15-6-4-3-5-13(12)15/h3-9,14H,10,17H2,1-2H3
InChIKeyFDKPFQDGKKZTNS-UHFFFAOYSA-N
XLogP2.52
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,5-dimethylpyrazol-3-yl)-2-(2-methylphenyl)ethanamine
CID 105091850
2-(1-benzothiophen-3-yl)-1-(2,5-dimethylpyrazol-3-yl)ethanamine
CID 105116784
1-(2-bromo-4-methylphenyl)-2-quinolin-4-ylethanamine
CID 104997439
1-(4-chloro-3-methylphenyl)-2-quinolin-4-ylethanamine
CID 104997370
1-(4-bromo-2-methylphenyl)-2-quinolin-4-ylethanamine
CID 104997339
1-(3,5-dichlorophenyl)-2-quinolin-4-ylethanamine
CID 104997404
[(2,5-dimethylpyrazol-3-yl)-quinolin-5-ylmethyl]hydrazine
CID 105326968
1-(3-bromo-2-methylphenyl)-2-quinolin-4-ylethanamine
CID 104997403
1-(2-iodophenyl)-2-quinolin-4-ylethanamine
CID 104997408
[1-(1,3-dimethylpyrazol-4-yl)-2-quinolin-4-ylethyl]hydrazine
CID 102805020
1-(1,5-dimethylpyrazol-4-yl)-2-quinolin-4-ylethanol
CID 79584284
1-(2,5-dimethylpyrazol-3-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanamine
CID 105164424

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine?
The IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine (CID 105159324) is 1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine.
What is the SMILES notation for 1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine?
The canonical SMILES for 1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine is Cc1cc(C(N)Cc2ccnc3ccccc23)n(C)n1.
What is the InChIKey of 1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine?
The InChIKey is FDKPFQDGKKZTNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-11-9-16(20(2)19-11)14(17)10-12-7-8-18-15-6-4-3-5-13(12)15/h3-9,14H,10,17H2,1-2H3.
What are the key properties of 1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine?
1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine has a molecular weight of 266.35 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylpyrazol-3-yl)-2-quinolin-4-ylethanamine is sourced from PubChem (CID 105159324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).