(2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine

C15H16N4 — CID 105148379

IUPAC(2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine
SMILESCCn1nccc1C(N)c1cccc2cccnc12
InChIInChI=1S/C15H16N4/c1-2-19-13(8-10-18-19)14(16)12-7-3-5-11-6-4-9-17-15(11)12/h3-10,14H,2,16H2,1H3
InChIKeyYSGUBKOMGAMTAE-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.50
Rot. Bonds3

About (2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine

(2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine (PubChem CID 105148379) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is (2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine.

Molecular Properties

Compound Name(2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine
PubChem CID105148379
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name(2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine
SMILESCCn1nccc1C(N)c1cccc2cccnc12
InChIInChI=1S/C15H16N4/c1-2-19-13(8-10-18-19)14(16)12-7-3-5-11-6-4-9-17-15(11)12/h3-10,14H,2,16H2,1H3
InChIKeyYSGUBKOMGAMTAE-UHFFFAOYSA-N
XLogP2.50
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1-ethylpyrazol-4-yl)-quinolin-8-ylmethanamine
CID 105109051
(2-ethylpyrazol-3-yl)-(2-fluorophenyl)methanamine
CID 63976398
naphthalen-1-yl-(2-propylpyrazol-3-yl)methanamine
CID 63976392
(2-ethylpyrazol-3-yl)-(2,4,5-trimethoxyphenyl)methanamine
CID 115857825
(2,6-difluorophenyl)-(2-ethylpyrazol-3-yl)methanamine
CID 79522981
(3-ethoxyphenyl)-(2-ethylpyrazol-3-yl)methanamine
CID 63975299
1-quinolin-8-ylbutan-1-amine
CID 79016206
(2-ethylpyrazol-3-yl)-(2-methylfuran-3-yl)methanamine
CID 104789763
(3-chloro-2-methylphenyl)-quinolin-8-ylmethanamine
CID 107102903
(1,5-dimethylpyrazol-4-yl)-(2-ethylpyrazol-3-yl)methanamine
CID 105148404
(2-methylsulfanylphenyl)-quinolin-8-ylmethanamine
CID 105021362
(3-bromophenyl)-(2-ethylpyrazol-3-yl)methanamine
CID 63977430

Frequently Asked Questions

What is the IUPAC name of (2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine?
The IUPAC name of (2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine (CID 105148379) is (2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine.
What is the SMILES notation for (2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine?
The canonical SMILES for (2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine is CCn1nccc1C(N)c1cccc2cccnc12.
What is the InChIKey of (2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine?
The InChIKey is YSGUBKOMGAMTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-2-19-13(8-10-18-19)14(16)12-7-3-5-11-6-4-9-17-15(11)12/h3-10,14H,2,16H2,1H3.
What are the key properties of (2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine?
(2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine has a molecular weight of 252.32 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpyrazol-3-yl)-quinolin-8-ylmethanamine is sourced from PubChem (CID 105148379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).