N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine

C15H21N3 — CID 79834912

IUPACN-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine
SMILESCC1(C)CCCCC1Nc1cccc2cn[nH]c12
InChIInChI=1S/C15H21N3/c1-15(2)9-4-3-8-13(15)17-12-7-5-6-11-10-16-18-14(11)12/h5-7,10,13,17H,3-4,8-9H2,1-2H3,(H,16,18)
InChIKeyYRKSQMLWYAJGAU-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.94
Rot. Bonds2

About N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine

N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine (PubChem CID 79834912) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine.

Molecular Properties

Compound NameN-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine
PubChem CID79834912
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC NameN-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine
SMILESCC1(C)CCCCC1Nc1cccc2cn[nH]c12
InChIInChI=1S/C15H21N3/c1-15(2)9-4-3-8-13(15)17-12-7-5-6-11-10-16-18-14(11)12/h5-7,10,13,17H,3-4,8-9H2,1-2H3,(H,16,18)
InChIKeyYRKSQMLWYAJGAU-UHFFFAOYSA-N
XLogP3.94
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine?
The IUPAC name of N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine (CID 79834912) is N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine.
What is the SMILES notation for N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine?
The canonical SMILES for N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine is CC1(C)CCCCC1Nc1cccc2cn[nH]c12.
What is the InChIKey of N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine?
The InChIKey is YRKSQMLWYAJGAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-15(2)9-4-3-8-13(15)17-12-7-5-6-11-10-16-18-14(11)12/h5-7,10,13,17H,3-4,8-9H2,1-2H3,(H,16,18).
What are the key properties of N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine?
N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine has a molecular weight of 243.35 g/mol, XLogP of 3.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine is sourced from PubChem (CID 79834912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).