5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine

C11H9ClN4 — CID 136985567

IUPAC5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine
SMILESNc1cc(-c2cc3cccc(Cl)c3[nH]2)[nH]n1
InChIInChI=1S/C11H9ClN4/c12-7-3-1-2-6-4-8(14-11(6)7)9-5-10(13)16-15-9/h1-5,14H,(H3,13,15,16)
InChIKeyWTYFLNGBGNDVAD-UHFFFAOYSA-N
MW232.67 g/mol
LogP2.79
Rot. Bonds1

About 5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine

5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine (PubChem CID 136985567) has the molecular formula C11H9ClN4 and a molecular weight of 232.67 g/mol. Its IUPAC name is 5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine
PubChem CID136985567
Molecular FormulaC11H9ClN4
Molecular Weight232.67 g/mol
Exact Mass232.05
IUPAC Name5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine
SMILESNc1cc(-c2cc3cccc(Cl)c3[nH]2)[nH]n1
InChIInChI=1S/C11H9ClN4/c12-7-3-1-2-6-4-8(14-11(6)7)9-5-10(13)16-15-9/h1-5,14H,(H3,13,15,16)
InChIKeyWTYFLNGBGNDVAD-UHFFFAOYSA-N
XLogP2.79
TPSA70.49 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.67
LogP ≤ 52.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

5-[7-(trifluoromethyl)-1H-indol-2-yl]-1H-pyrazol-3-amine
CID 136985546
5-(7-chloro-1H-indol-2-yl)-1,2-oxazol-3-amine
CID 136985724
6-(7-chloro-1H-indol-2-yl)pyridin-3-amine
CID 115110380
7-chloro-2-(4-chlorophenyl)-1H-indole
CID 14045525
5-(3-chloro-2-fluorophenyl)-1H-pyrazol-3-amine
CID 81265191
5-(3-chloro-2-methylphenyl)-1H-pyrazol-3-amine
CID 67188640
5-(7-chloro-1H-indol-2-yl)-1H-pyrrole-2-carboxylic acid
CID 115110110
5-(5-fluoro-1H-indol-2-yl)-1H-pyrazol-3-amine
CID 136985649
1-(7-chloro-1H-indol-2-yl)ethanamine
CID 65333202
7-chloro-2-(4-methoxyphenyl)-1H-indole
CID 131886896
7-chloro-2-fluoro-1H-indole
CID 150428861
5-(4-chloro-1-benzothiophen-2-yl)-1H-pyrazol-3-amine
CID 115110039

Frequently Asked Questions

What is the IUPAC name of 5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine (CID 136985567) is 5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine is Nc1cc(-c2cc3cccc(Cl)c3[nH]2)[nH]n1.
What is the InChIKey of 5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine?
The InChIKey is WTYFLNGBGNDVAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN4/c12-7-3-1-2-6-4-8(14-11(6)7)9-5-10(13)16-15-9/h1-5,14H,(H3,13,15,16).
What are the key properties of 5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine?
5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine has a molecular weight of 232.67 g/mol, XLogP of 2.79, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(7-chloro-1H-indol-2-yl)-1H-pyrazol-3-amine is sourced from PubChem (CID 136985567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).