5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine

C13H16N4 — CID 117329151

IUPAC5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine
SMILESCN1CCCc2c(-c3cc(N)n[nH]3)cccc21
InChIInChI=1S/C13H16N4/c1-17-7-3-5-10-9(4-2-6-12(10)17)11-8-13(14)16-15-11/h2,4,6,8H,3,5,7H2,1H3,(H3,14,15,16)
InChIKeyKNCXRYGIGLRRFT-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.04
Rot. Bonds1

About 5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine

5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine (PubChem CID 117329151) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine
PubChem CID117329151
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine
SMILESCN1CCCc2c(-c3cc(N)n[nH]3)cccc21
InChIInChI=1S/C13H16N4/c1-17-7-3-5-10-9(4-2-6-12(10)17)11-8-13(14)16-15-11/h2,4,6,8H,3,5,7H2,1H3,(H3,14,15,16)
InChIKeyKNCXRYGIGLRRFT-UHFFFAOYSA-N
XLogP2.04
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1-methyl-2,3-dihydroindol-4-yl)-1H-pyrazol-3-amine
CID 117305701
5-(4-methoxy-1-methyl-2,3-dihydroindol-5-yl)-1H-pyrazol-3-amine
CID 117362780
1-methyl-2,3,4,5-tetrahydro-1-benzazepin-6-amine
CID 83852967
1,5-dimethyl-3,4-dihydro-2H-quinoline;ethane
CID 144655769
1-methyl-5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)pyrazole-3-carboxylic acid
CID 117431145
5-[2-(triazol-2-yl)phenyl]-1H-pyrazol-3-amine
CID 117325181
5-[2-(triazol-1-yl)phenyl]-1H-pyrazol-3-amine
CID 117325182
5-[3-fluoro-2-(trifluoromethyl)phenyl]-1H-pyrazol-3-amine
CID 117364136
5-[2-(pyrrolidin-1-ylmethyl)phenyl]-1H-pyrazol-3-amine
CID 117358203
5-(2-methyl-1,3-benzothiazol-7-yl)-1H-pyrazol-3-amine
CID 117332684
4-(3-amino-1H-pyrazol-5-yl)-1,3-dihydroindol-2-one
CID 117305337
5-(3-chloro-2-methylphenyl)-1H-pyrazol-3-amine
CID 67188640

Frequently Asked Questions

What is the IUPAC name of 5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine (CID 117329151) is 5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine is CN1CCCc2c(-c3cc(N)n[nH]3)cccc21.
What is the InChIKey of 5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine?
The InChIKey is KNCXRYGIGLRRFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-17-7-3-5-10-9(4-2-6-12(10)17)11-8-13(14)16-15-11/h2,4,6,8H,3,5,7H2,1H3,(H3,14,15,16).
What are the key properties of 5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine?
5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine has a molecular weight of 228.30 g/mol, XLogP of 2.04, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methyl-3,4-dihydro-2H-quinolin-5-yl)-1H-pyrazol-3-amine is sourced from PubChem (CID 117329151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).