1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine

C13H15N5 — CID 103118715

IUPAC1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine
SMILESCc1c(-c2nn(C)c3ccccc23)nn(C)c1N
InChIInChI=1S/C13H15N5/c1-8-11(15-18(3)13(8)14)12-9-6-4-5-7-10(9)17(2)16-12/h4-7H,14H2,1-3H3
InChIKeyKINWJXPSCOMHQK-UHFFFAOYSA-N
MW241.30 g/mol
LogP1.86
Rot. Bonds1

About 1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine

1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine (PubChem CID 103118715) has the molecular formula C13H15N5 and a molecular weight of 241.30 g/mol. Its IUPAC name is 1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine.

Molecular Properties

Compound Name1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine
PubChem CID103118715
Molecular FormulaC13H15N5
Molecular Weight241.30 g/mol
Exact Mass241.13
IUPAC Name1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine
SMILESCc1c(-c2nn(C)c3ccccc23)nn(C)c1N
InChIInChI=1S/C13H15N5/c1-8-11(15-18(3)13(8)14)12-9-6-4-5-7-10(9)17(2)16-12/h4-7H,14H2,1-3H3
InChIKeyKINWJXPSCOMHQK-UHFFFAOYSA-N
XLogP1.86
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.30
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1,4-dimethyl-3-pyrimidin-2-ylpyrazol-5-amine
CID 114552607
1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole
CID 103119734
4-amino-6-(1-methylindazol-3-yl)-1H-1,3,5-triazin-2-one
CID 136980728
1-methyl-3-thiophen-2-ylindazole
CID 57338749
1,4-dimethyl-3-thiophen-2-ylpyrazol-5-amine
CID 4737047
3-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]-1-methylindazole
CID 103123714
3-iodo-5-(1-methylindazol-3-yl)-1,2,4-thiadiazole
CID 103130052
8-(1-methylindazol-3-yl)-7H-purin-6-amine
CID 136785887
3-methyl-2-(1-methylindazol-4-yl)quinolin-4-amine
CID 142789179
(1S)-1-(1-methylindazol-3-yl)ethanamine
CID 96741257
2-methyl-5-(1-methylindazol-3-yl)-1H-1,2,4-triazole-3-thione
CID 103119827
5-(1-methylindazol-3-yl)thiophene-2-carbaldehyde
CID 177498837

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine?
The IUPAC name of 1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine (CID 103118715) is 1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine.
What is the SMILES notation for 1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine?
The canonical SMILES for 1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine is Cc1c(-c2nn(C)c3ccccc23)nn(C)c1N.
What is the InChIKey of 1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine?
The InChIKey is KINWJXPSCOMHQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5/c1-8-11(15-18(3)13(8)14)12-9-6-4-5-7-10(9)17(2)16-12/h4-7H,14H2,1-3H3.
What are the key properties of 1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine?
1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine has a molecular weight of 241.30 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine is sourced from PubChem (CID 103118715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).