N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine

C14H24N2O — CID 113370845

IUPACN-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine
SMILESCCC(Nc1ncccc1OC(C)C)C(C)C
InChIInChI=1S/C14H24N2O/c1-6-12(10(2)3)16-14-13(17-11(4)5)8-7-9-15-14/h7-12H,6H2,1-5H3,(H,15,16)
InChIKeyIUZBYCQHDBDWSI-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.72
Rot. Bonds6

About N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine

N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine (PubChem CID 113370845) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine.

Molecular Properties

Compound NameN-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine
PubChem CID113370845
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine
SMILESCCC(Nc1ncccc1OC(C)C)C(C)C
InChIInChI=1S/C14H24N2O/c1-6-12(10(2)3)16-14-13(17-11(4)5)8-7-9-15-14/h7-12H,6H2,1-5H3,(H,15,16)
InChIKeyIUZBYCQHDBDWSI-UHFFFAOYSA-N
XLogP3.72
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine?
The IUPAC name of N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine (CID 113370845) is N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine.
What is the SMILES notation for N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine?
The canonical SMILES for N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine is CCC(Nc1ncccc1OC(C)C)C(C)C.
What is the InChIKey of N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine?
The InChIKey is IUZBYCQHDBDWSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-6-12(10(2)3)16-14-13(17-11(4)5)8-7-9-15-14/h7-12H,6H2,1-5H3,(H,15,16).
What are the key properties of N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine?
N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine has a molecular weight of 236.36 g/mol, XLogP of 3.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine is sourced from PubChem (CID 113370845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).