N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine

C15H22N2O — CID 63454222

IUPACN-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ncccc1NC1CC2CCC1C2
InChIInChI=1S/C15H22N2O/c1-10(2)18-15-13(4-3-7-16-15)17-14-9-11-5-6-12(14)8-11/h3-4,7,10-12,14,17H,5-6,8-9H2,1-2H3
InChIKeyYUGBOVVIVVQQKL-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.47
Rot. Bonds4

About N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine

N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine (PubChem CID 63454222) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine
PubChem CID63454222
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ncccc1NC1CC2CCC1C2
InChIInChI=1S/C15H22N2O/c1-10(2)18-15-13(4-3-7-16-15)17-14-9-11-5-6-12(14)8-11/h3-4,7,10-12,14,17H,5-6,8-9H2,1-2H3
InChIKeyYUGBOVVIVVQQKL-UHFFFAOYSA-N
XLogP3.47
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine (CID 63454222) is N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine is CC(C)Oc1ncccc1NC1CC2CCC1C2.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine?
The InChIKey is YUGBOVVIVVQQKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-10(2)18-15-13(4-3-7-16-15)17-14-9-11-5-6-12(14)8-11/h3-4,7,10-12,14,17H,5-6,8-9H2,1-2H3.
What are the key properties of N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine?
N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine has a molecular weight of 246.35 g/mol, XLogP of 3.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 63454222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).