(3-chloro-1-methylindazol-5-yl)methanamine

C9H10ClN3 — CID 83446741

IUPAC(3-chloro-1-methylindazol-5-yl)methanamine
SMILESCn1nc(Cl)c2cc(CN)ccc21
InChIInChI=1S/C9H10ClN3/c1-13-8-3-2-6(5-11)4-7(8)9(10)12-13/h2-4H,5,11H2,1H3
InChIKeyGDIWQUSXGLJDBI-UHFFFAOYSA-N
MW195.65 g/mol
LogP1.69
Rot. Bonds1

About (3-chloro-1-methylindazol-5-yl)methanamine

(3-chloro-1-methylindazol-5-yl)methanamine (PubChem CID 83446741) has the molecular formula C9H10ClN3 and a molecular weight of 195.65 g/mol. Its IUPAC name is (3-chloro-1-methylindazol-5-yl)methanamine.

Molecular Properties

Compound Name(3-chloro-1-methylindazol-5-yl)methanamine
PubChem CID83446741
Molecular FormulaC9H10ClN3
Molecular Weight195.65 g/mol
Exact Mass195.06
IUPAC Name(3-chloro-1-methylindazol-5-yl)methanamine
SMILESCn1nc(Cl)c2cc(CN)ccc21
InChIInChI=1S/C9H10ClN3/c1-13-8-3-2-6(5-11)4-7(8)9(10)12-13/h2-4H,5,11H2,1H3
InChIKeyGDIWQUSXGLJDBI-UHFFFAOYSA-N
XLogP1.69
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.65
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-chloro-1-methylindazol-5-yl)propanal
CID 117318873
(3-chloro-1-methylindazol-5-yl)methanesulfonyl chloride
CID 84714969
2-amino-3-(3-chloro-1-methylindazol-5-yl)propanoic acid
CID 117387142
5-(aminomethyl)-1-methylindazole-3-carboxylic acid
CID 84778324
(E)-3-(3-chloro-1-methylindazol-5-yl)prop-2-en-1-amine
CID 117317344
5-tert-butyl-3-chloro-1-methylindazole
CID 169058983
(3-cyclopropyl-1-methylindazol-6-yl)methanamine
CID 105453741
5-(3-chloro-1-methylindazol-5-yl)-1,2-oxazol-3-amine
CID 117374897
3-[5-(aminomethyl)-1-methylindazol-3-yl]piperidine-2,6-dione
CID 138460739
3-chloro-6-(isocyanatomethyl)-1-methylindazole
CID 117317274
O-[2-(3-bromo-1-methylindazol-5-yl)ethyl]hydroxylamine
CID 117428299
(3-tert-butyl-2-methylindazol-5-yl)methanamine
CID 105471747

Frequently Asked Questions

What is the IUPAC name of (3-chloro-1-methylindazol-5-yl)methanamine?
The IUPAC name of (3-chloro-1-methylindazol-5-yl)methanamine (CID 83446741) is (3-chloro-1-methylindazol-5-yl)methanamine.
What is the SMILES notation for (3-chloro-1-methylindazol-5-yl)methanamine?
The canonical SMILES for (3-chloro-1-methylindazol-5-yl)methanamine is Cn1nc(Cl)c2cc(CN)ccc21.
What is the InChIKey of (3-chloro-1-methylindazol-5-yl)methanamine?
The InChIKey is GDIWQUSXGLJDBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN3/c1-13-8-3-2-6(5-11)4-7(8)9(10)12-13/h2-4H,5,11H2,1H3.
What are the key properties of (3-chloro-1-methylindazol-5-yl)methanamine?
(3-chloro-1-methylindazol-5-yl)methanamine has a molecular weight of 195.65 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-1-methylindazol-5-yl)methanamine is sourced from PubChem (CID 83446741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).