(7-chloro-2-propan-2-ylindazol-3-yl)methanamine

C11H14ClN3 — CID 84725346

IUPAC(7-chloro-2-propan-2-ylindazol-3-yl)methanamine
SMILESCC(C)n1nc2c(Cl)cccc2c1CN
InChIInChI=1S/C11H14ClN3/c1-7(2)15-10(6-13)8-4-3-5-9(12)11(8)14-15/h3-5,7H,6,13H2,1-2H3
InChIKeyBUGRANCOZBKMBI-UHFFFAOYSA-N
MW223.71 g/mol
LogP2.73
Rot. Bonds2

About (7-chloro-2-propan-2-ylindazol-3-yl)methanamine

(7-chloro-2-propan-2-ylindazol-3-yl)methanamine (PubChem CID 84725346) has the molecular formula C11H14ClN3 and a molecular weight of 223.71 g/mol. Its IUPAC name is (7-chloro-2-propan-2-ylindazol-3-yl)methanamine.

Molecular Properties

Compound Name(7-chloro-2-propan-2-ylindazol-3-yl)methanamine
PubChem CID84725346
Molecular FormulaC11H14ClN3
Molecular Weight223.71 g/mol
Exact Mass223.09
IUPAC Name(7-chloro-2-propan-2-ylindazol-3-yl)methanamine
SMILESCC(C)n1nc2c(Cl)cccc2c1CN
InChIInChI=1S/C11H14ClN3/c1-7(2)15-10(6-13)8-4-3-5-9(12)11(8)14-15/h3-5,7H,6,13H2,1-2H3
InChIKeyBUGRANCOZBKMBI-UHFFFAOYSA-N
XLogP2.73
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.71
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(7-methyl-2-propan-2-ylindazol-3-yl)methanamine
CID 84721653
(7-chloro-2-propan-2-ylindazol-3-yl)methanol
CID 84725616
3-bromo-7-chloro-2-propan-2-ylindazole
CID 84730201
2-(4-chloro-2-propan-2-ylindazol-3-yl)ethanamine
CID 84727595
3-chloro-7-fluoro-2-propan-2-ylindazole
CID 84723451
2-(8-chloro-4-methylquinolin-2-yl)ethanamine
CID 82575547
7-chloro-2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
CID 169150906
2-chloro-6-(1-propan-2-yltetrazol-5-yl)aniline
CID 115547874
1-(3-methyl-2-propan-2-ylindazol-7-yl)cyclopropan-1-amine
CID 84726186
4-chloro-2-methyl-1-propan-2-ylbenzimidazole
CID 83449668
2-(aminomethyl)-8-chloroquinazolin-4-amine
CID 105462502
(5-chloro-1-methylnaphthalen-2-yl)methanamine
CID 115057593

Frequently Asked Questions

What is the IUPAC name of (7-chloro-2-propan-2-ylindazol-3-yl)methanamine?
The IUPAC name of (7-chloro-2-propan-2-ylindazol-3-yl)methanamine (CID 84725346) is (7-chloro-2-propan-2-ylindazol-3-yl)methanamine.
What is the SMILES notation for (7-chloro-2-propan-2-ylindazol-3-yl)methanamine?
The canonical SMILES for (7-chloro-2-propan-2-ylindazol-3-yl)methanamine is CC(C)n1nc2c(Cl)cccc2c1CN.
What is the InChIKey of (7-chloro-2-propan-2-ylindazol-3-yl)methanamine?
The InChIKey is BUGRANCOZBKMBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3/c1-7(2)15-10(6-13)8-4-3-5-9(12)11(8)14-15/h3-5,7H,6,13H2,1-2H3.
What are the key properties of (7-chloro-2-propan-2-ylindazol-3-yl)methanamine?
(7-chloro-2-propan-2-ylindazol-3-yl)methanamine has a molecular weight of 223.71 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-chloro-2-propan-2-ylindazol-3-yl)methanamine is sourced from PubChem (CID 84725346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).