N-butan-2-yl-1H-indazol-7-amine

C11H15N3 — CID 43730948

IUPACN-butan-2-yl-1H-indazol-7-amine
SMILESCCC(C)Nc1cccc2cn[nH]c12
InChIInChI=1S/C11H15N3/c1-3-8(2)13-10-6-4-5-9-7-12-14-11(9)10/h4-8,13H,3H2,1-2H3,(H,12,14)
InChIKeyISENIDAAVKVMTE-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.77
Rot. Bonds3

About N-butan-2-yl-1H-indazol-7-amine

N-butan-2-yl-1H-indazol-7-amine (PubChem CID 43730948) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is N-butan-2-yl-1H-indazol-7-amine.

Molecular Properties

Compound NameN-butan-2-yl-1H-indazol-7-amine
PubChem CID43730948
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC NameN-butan-2-yl-1H-indazol-7-amine
SMILESCCC(C)Nc1cccc2cn[nH]c12
InChIInChI=1S/C11H15N3/c1-3-8(2)13-10-6-4-5-9-7-12-14-11(9)10/h4-8,13H,3H2,1-2H3,(H,12,14)
InChIKeyISENIDAAVKVMTE-UHFFFAOYSA-N
XLogP2.77
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-1H-indazol-7-amine?
The IUPAC name of N-butan-2-yl-1H-indazol-7-amine (CID 43730948) is N-butan-2-yl-1H-indazol-7-amine.
What is the SMILES notation for N-butan-2-yl-1H-indazol-7-amine?
The canonical SMILES for N-butan-2-yl-1H-indazol-7-amine is CCC(C)Nc1cccc2cn[nH]c12.
What is the InChIKey of N-butan-2-yl-1H-indazol-7-amine?
The InChIKey is ISENIDAAVKVMTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-3-8(2)13-10-6-4-5-9-7-12-14-11(9)10/h4-8,13H,3H2,1-2H3,(H,12,14).
What are the key properties of N-butan-2-yl-1H-indazol-7-amine?
N-butan-2-yl-1H-indazol-7-amine has a molecular weight of 189.26 g/mol, XLogP of 2.77, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-1H-indazol-7-amine is sourced from PubChem (CID 43730948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).