2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine

C15H16N2OS — CID 43262642

IUPAC2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine
SMILESNc1ccc(Sc2ccccc2)nc1OCC1CC1
InChIInChI=1S/C15H16N2OS/c16-13-8-9-14(19-12-4-2-1-3-5-12)17-15(13)18-10-11-6-7-11/h1-5,8-9,11H,6-7,10,16H2
InChIKeyCSCRPYXRCAEVHL-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.60
Rot. Bonds5

About 2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine

2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine (PubChem CID 43262642) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine
PubChem CID43262642
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC Name2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine
SMILESNc1ccc(Sc2ccccc2)nc1OCC1CC1
InChIInChI=1S/C15H16N2OS/c16-13-8-9-14(19-12-4-2-1-3-5-12)17-15(13)18-10-11-6-7-11/h1-5,8-9,11H,6-7,10,16H2
InChIKeyCSCRPYXRCAEVHL-UHFFFAOYSA-N
XLogP3.60
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-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 2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine?
The IUPAC name of 2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine (CID 43262642) is 2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine?
The canonical SMILES for 2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine is Nc1ccc(Sc2ccccc2)nc1OCC1CC1.
What is the InChIKey of 2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine?
The InChIKey is CSCRPYXRCAEVHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c16-13-8-9-14(19-12-4-2-1-3-5-12)17-15(13)18-10-11-6-7-11/h1-5,8-9,11H,6-7,10,16H2.
What are the key properties of 2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine?
2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine has a molecular weight of 272.37 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-6-phenylsulfanylpyridin-3-amine is sourced from PubChem (CID 43262642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).