1-(2-propan-2-ylindazol-6-yl)propan-2-amine

C13H19N3 — CID 84724116

IUPAC1-(2-propan-2-ylindazol-6-yl)propan-2-amine
SMILESCC(N)Cc1ccc2cn(C(C)C)nc2c1
InChIInChI=1S/C13H19N3/c1-9(2)16-8-12-5-4-11(6-10(3)14)7-13(12)15-16/h4-5,7-10H,6,14H2,1-3H3
InChIKeyJUUJNGGEQFCVPN-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.51
Rot. Bonds3

About 1-(2-propan-2-ylindazol-6-yl)propan-2-amine

1-(2-propan-2-ylindazol-6-yl)propan-2-amine (PubChem CID 84724116) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 1-(2-propan-2-ylindazol-6-yl)propan-2-amine.

Molecular Properties

Compound Name1-(2-propan-2-ylindazol-6-yl)propan-2-amine
PubChem CID84724116
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name1-(2-propan-2-ylindazol-6-yl)propan-2-amine
SMILESCC(N)Cc1ccc2cn(C(C)C)nc2c1
InChIInChI=1S/C13H19N3/c1-9(2)16-8-12-5-4-11(6-10(3)14)7-13(12)15-16/h4-5,7-10H,6,14H2,1-3H3
InChIKeyJUUJNGGEQFCVPN-UHFFFAOYSA-N
XLogP2.51
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-propan-2-ylindazol-6-yl)propan-2-amine?
The IUPAC name of 1-(2-propan-2-ylindazol-6-yl)propan-2-amine (CID 84724116) is 1-(2-propan-2-ylindazol-6-yl)propan-2-amine.
What is the SMILES notation for 1-(2-propan-2-ylindazol-6-yl)propan-2-amine?
The canonical SMILES for 1-(2-propan-2-ylindazol-6-yl)propan-2-amine is CC(N)Cc1ccc2cn(C(C)C)nc2c1.
What is the InChIKey of 1-(2-propan-2-ylindazol-6-yl)propan-2-amine?
The InChIKey is JUUJNGGEQFCVPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-9(2)16-8-12-5-4-11(6-10(3)14)7-13(12)15-16/h4-5,7-10H,6,14H2,1-3H3.
What are the key properties of 1-(2-propan-2-ylindazol-6-yl)propan-2-amine?
1-(2-propan-2-ylindazol-6-yl)propan-2-amine has a molecular weight of 217.32 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-propan-2-ylindazol-6-yl)propan-2-amine is sourced from PubChem (CID 84724116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).