N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine

C13H16N4 — CID 67234298

IUPACN-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine
SMILESc1cc2[nH]ncc2cc1NC12CCC(C1)NC2
InChIInChI=1S/C13H16N4/c1-2-12-9(7-15-17-12)5-10(1)16-13-4-3-11(6-13)14-8-13/h1-2,5,7,11,14,16H,3-4,6,8H2,(H,15,17)
InChIKeyAMJFHHVDSDFKPU-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.87
Rot. Bonds2

About N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine

N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine (PubChem CID 67234298) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine.

Molecular Properties

Compound NameN-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine
PubChem CID67234298
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC NameN-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine
SMILESc1cc2[nH]ncc2cc1NC12CCC(C1)NC2
InChIInChI=1S/C13H16N4/c1-2-12-9(7-15-17-12)5-10(1)16-13-4-3-11(6-13)14-8-13/h1-2,5,7,11,14,16H,3-4,6,8H2,(H,15,17)
InChIKeyAMJFHHVDSDFKPU-UHFFFAOYSA-N
XLogP1.87
TPSA52.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-cyclopropylphenyl)methyl]-1H-indazol-5-amine
CID 79968714
2-N-(1H-indazol-5-yl)spiro[2.5]octane-2,6-diamine
CID 163894875
N-(7-azabicyclo[2.2.1]heptan-2-yl)-1H-indazol-5-amine
CID 67234945
N-(1,4-dioxaspiro[4.5]decan-8-yl)-1H-indazol-5-amine
CID 43690947
N-(piperidin-2-ylmethyl)-1H-indazol-5-amine
CID 106633290
N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine
CID 79536417
1-(cyclopropylmethyl)-3-(1H-indazol-5-yl)urea
CID 166196110
5-(sulfinoamino)-1H-indazole
CID 68877895
N-(4-fluorophenyl)-1H-indazol-5-amine
CID 91229030
ethyl 1-(1H-indazol-5-ylamino)cyclobutane-1-carboxylate
CID 67336209
2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide
CID 82765921
(2R,5S)-5-(1H-indazol-5-ylcarbamoyl)oxolane-2-carboxylic acid
CID 102944700

Frequently Asked Questions

What is the IUPAC name of N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine?
The IUPAC name of N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine (CID 67234298) is N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine.
What is the SMILES notation for N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine?
The canonical SMILES for N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine is c1cc2[nH]ncc2cc1NC12CCC(C1)NC2.
What is the InChIKey of N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine?
The InChIKey is AMJFHHVDSDFKPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-2-12-9(7-15-17-12)5-10(1)16-13-4-3-11(6-13)14-8-13/h1-2,5,7,11,14,16H,3-4,6,8H2,(H,15,17).
What are the key properties of N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine?
N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine has a molecular weight of 228.30 g/mol, XLogP of 1.87, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-azabicyclo[2.2.1]heptan-4-yl)-1H-indazol-5-amine is sourced from PubChem (CID 67234298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).