1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine

C10H10BrN3 — CID 175349705

IUPAC1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine
SMILESNC1(c2[nH]nc3ccc(Br)cc23)CC1
InChIInChI=1S/C10H10BrN3/c11-6-1-2-8-7(5-6)9(14-13-8)10(12)3-4-10/h1-2,5H,3-4,12H2,(H,13,14)
InChIKeyYYRXZVYCKGMHSM-UHFFFAOYSA-N
MW252.11 g/mol
LogP2.27
Rot. Bonds1

About 1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine

1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine (PubChem CID 175349705) has the molecular formula C10H10BrN3 and a molecular weight of 252.11 g/mol. Its IUPAC name is 1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine
PubChem CID175349705
Molecular FormulaC10H10BrN3
Molecular Weight252.11 g/mol
Exact Mass251.01
IUPAC Name1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine
SMILESNC1(c2[nH]nc3ccc(Br)cc23)CC1
InChIInChI=1S/C10H10BrN3/c11-6-1-2-8-7(5-6)9(14-13-8)10(12)3-4-10/h1-2,5H,3-4,12H2,(H,13,14)
InChIKeyYYRXZVYCKGMHSM-UHFFFAOYSA-N
XLogP2.27
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.11
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine?
The IUPAC name of 1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine (CID 175349705) is 1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine.
What is the SMILES notation for 1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine?
The canonical SMILES for 1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine is NC1(c2[nH]nc3ccc(Br)cc23)CC1.
What is the InChIKey of 1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine?
The InChIKey is YYRXZVYCKGMHSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3/c11-6-1-2-8-7(5-6)9(14-13-8)10(12)3-4-10/h1-2,5H,3-4,12H2,(H,13,14).
What are the key properties of 1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine?
1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine has a molecular weight of 252.11 g/mol, XLogP of 2.27, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine is sourced from PubChem (CID 175349705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).