1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine

C11H12BrN3 — CID 84729766

IUPAC1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine
SMILESCn1nc2cc(C3(N)CC3)ccc2c1Br
InChIInChI=1S/C11H12BrN3/c1-15-10(12)8-3-2-7(6-9(8)14-15)11(13)4-5-11/h2-3,6H,4-5,13H2,1H3
InChIKeyBJZAQRVNSVYRHU-UHFFFAOYSA-N
MW266.14 g/mol
LogP2.28
Rot. Bonds1

About 1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine

1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine (PubChem CID 84729766) has the molecular formula C11H12BrN3 and a molecular weight of 266.14 g/mol. Its IUPAC name is 1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine
PubChem CID84729766
Molecular FormulaC11H12BrN3
Molecular Weight266.14 g/mol
Exact Mass265.02
IUPAC Name1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine
SMILESCn1nc2cc(C3(N)CC3)ccc2c1Br
InChIInChI=1S/C11H12BrN3/c1-15-10(12)8-3-2-7(6-9(8)14-15)11(13)4-5-11/h2-3,6H,4-5,13H2,1H3
InChIKeyBJZAQRVNSVYRHU-UHFFFAOYSA-N
XLogP2.28
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.14
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-ethyl-3-methylindazol-6-yl)cyclopropan-1-amine
CID 84723789
3-bromo-2,6-dimethylindazole
CID 84725646
3-bromo-6-methoxy-2-methylindazole
CID 84728133
1-(1-ethyl-3-methylindazol-5-yl)cyclopropan-1-amine
CID 84723795
1-[3-bromo-4-(2-fluoropropan-2-yl)phenyl]cyclopropan-1-amine
CID 84809656
1-(3,4-diethylphenyl)cyclobutan-1-amine
CID 117292089
1-(2-ethyl-4-pyridinyl)cyclopropan-1-amine
CID 126992100
1-(4-bromo-3-methoxyphenyl)cyclopropan-1-amine
CID 84801514
4-(1-aminocyclopropyl)-N,N-diethylaniline
CID 82609357
5-(1-aminocyclopropyl)-3-methyl-1,3-benzoxazol-2-one
CID 117292543
1-(3-bromophenyl)cyclopropan-1-amine
CID 11127564
1-[3-(2-methylpropyl)-2,1-benzoxazol-5-yl]cyclopropan-1-amine
CID 105488356

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine?
The IUPAC name of 1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine (CID 84729766) is 1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine.
What is the SMILES notation for 1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine?
The canonical SMILES for 1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine is Cn1nc2cc(C3(N)CC3)ccc2c1Br.
What is the InChIKey of 1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine?
The InChIKey is BJZAQRVNSVYRHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrN3/c1-15-10(12)8-3-2-7(6-9(8)14-15)11(13)4-5-11/h2-3,6H,4-5,13H2,1H3.
What are the key properties of 1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine?
1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine has a molecular weight of 266.14 g/mol, XLogP of 2.28, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromo-2-methylindazol-6-yl)cyclopropan-1-amine is sourced from PubChem (CID 84729766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).