N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide

C13H20N2OS — CID 102556019

IUPACN,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide
SMILESCC1c2ccsc2CCN1CCC(=O)N(C)C
InChIInChI=1S/C13H20N2OS/c1-10-11-6-9-17-12(11)4-7-15(10)8-5-13(16)14(2)3/h6,9-10H,4-5,7-8H2,1-3H3
InChIKeyNKQGUZDSRJXUPM-UHFFFAOYSA-N
MW252.38 g/mol
LogP2.15
Rot. Bonds3

About N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide

N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide (PubChem CID 102556019) has the molecular formula C13H20N2OS and a molecular weight of 252.38 g/mol. Its IUPAC name is N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide.

Molecular Properties

Compound NameN,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide
PubChem CID102556019
Molecular FormulaC13H20N2OS
Molecular Weight252.38 g/mol
Exact Mass252.13
IUPAC NameN,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide
SMILESCC1c2ccsc2CCN1CCC(=O)N(C)C
InChIInChI=1S/C13H20N2OS/c1-10-11-6-9-17-12(11)4-7-15(10)8-5-13(16)14(2)3/h6,9-10H,4-5,7-8H2,1-3H3
InChIKeyNKQGUZDSRJXUPM-UHFFFAOYSA-N
XLogP2.15
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide 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,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide?
The IUPAC name of N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide (CID 102556019) is N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide.
What is the SMILES notation for N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide?
The canonical SMILES for N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide is CC1c2ccsc2CCN1CCC(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide?
The InChIKey is NKQGUZDSRJXUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2OS/c1-10-11-6-9-17-12(11)4-7-15(10)8-5-13(16)14(2)3/h6,9-10H,4-5,7-8H2,1-3H3.
What are the key properties of N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide?
N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide has a molecular weight of 252.38 g/mol, XLogP of 2.15, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanamide is sourced from PubChem (CID 102556019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).