N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine

C14H19N3 — CID 103561698

IUPACN-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine
SMILESCC(C)C1CC(Nc2cccc3[nH]ncc23)C1
InChIInChI=1S/C14H19N3/c1-9(2)10-6-11(7-10)16-13-4-3-5-14-12(13)8-15-17-14/h3-5,8-11,16H,6-7H2,1-2H3,(H,15,17)
InChIKeyYWOVYMTWKMCINE-UHFFFAOYSA-N
MW229.33 g/mol
LogP3.41
Rot. Bonds3

About N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine

N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine (PubChem CID 103561698) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine.

Molecular Properties

Compound NameN-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine
PubChem CID103561698
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC NameN-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine
SMILESCC(C)C1CC(Nc2cccc3[nH]ncc23)C1
InChIInChI=1S/C14H19N3/c1-9(2)10-6-11(7-10)16-13-4-3-5-14-12(13)8-15-17-14/h3-5,8-11,16H,6-7H2,1-2H3,(H,15,17)
InChIKeyYWOVYMTWKMCINE-UHFFFAOYSA-N
XLogP3.41
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine?
The IUPAC name of N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine (CID 103561698) is N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine.
What is the SMILES notation for N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine?
The canonical SMILES for N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine is CC(C)C1CC(Nc2cccc3[nH]ncc23)C1.
What is the InChIKey of N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine?
The InChIKey is YWOVYMTWKMCINE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-9(2)10-6-11(7-10)16-13-4-3-5-14-12(13)8-15-17-14/h3-5,8-11,16H,6-7H2,1-2H3,(H,15,17).
What are the key properties of N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine?
N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine has a molecular weight of 229.33 g/mol, XLogP of 3.41, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine is sourced from PubChem (CID 103561698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).