(3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine

C17H18N2OS — CID 10382276

IUPAC(3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine
SMILESCNCC[C@@H](Oc1cncc2sccc12)c1ccccc1
InChIInChI=1S/C17H18N2OS/c1-18-9-7-15(13-5-3-2-4-6-13)20-16-11-19-12-17-14(16)8-10-21-17/h2-6,8,10-12,15,18H,7,9H2,1H3/t15-/m1/s1
InChIKeyWFIKMCLATLFEBS-OAHLLOKOSA-N
MW298.41 g/mol
LogP4.03
Rot. Bonds6

About (3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine

(3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine (PubChem CID 10382276) has the molecular formula C17H18N2OS and a molecular weight of 298.41 g/mol. Its IUPAC name is (3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine.

Molecular Properties

Compound Name(3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine
PubChem CID10382276
Molecular FormulaC17H18N2OS
Molecular Weight298.41 g/mol
Exact Mass298.11
IUPAC Name(3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine
SMILESCNCC[C@@H](Oc1cncc2sccc12)c1ccccc1
InChIInChI=1S/C17H18N2OS/c1-18-9-7-15(13-5-3-2-4-6-13)20-16-11-19-12-17-14(16)8-10-21-17/h2-6,8,10-12,15,18H,7,9H2,1H3/t15-/m1/s1
InChIKeyWFIKMCLATLFEBS-OAHLLOKOSA-N
XLogP4.03
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-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 (3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine?
The IUPAC name of (3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine (CID 10382276) is (3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine.
What is the SMILES notation for (3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine?
The canonical SMILES for (3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine is CNCC[C@@H](Oc1cncc2sccc12)c1ccccc1.
What is the InChIKey of (3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine?
The InChIKey is WFIKMCLATLFEBS-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H18N2OS/c1-18-9-7-15(13-5-3-2-4-6-13)20-16-11-19-12-17-14(16)8-10-21-17/h2-6,8,10-12,15,18H,7,9H2,1H3/t15-/m1/s1.
What are the key properties of (3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine?
(3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine has a molecular weight of 298.41 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-methyl-3-phenyl-3-thieno[2,3-c]pyridin-4-yloxypropan-1-amine is sourced from PubChem (CID 10382276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).