3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide

C15H16Cl2N2OS — CID 121479881

IUPAC3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCc1nc2sc(C(=O)NC3(C)CCC3)c(Cl)c2c(C)c1Cl
InChIInChI=1S/C15H16Cl2N2OS/c1-7-9-11(17)12(13(20)19-15(3)5-4-6-15)21-14(9)18-8(2)10(7)16/h4-6H2,1-3H3,(H,19,20)
InChIKeyFVHAHJGZMXCTSV-UHFFFAOYSA-N
MW343.28 g/mol
LogP4.89
Rot. Bonds2

About 3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide

3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 121479881) has the molecular formula C15H16Cl2N2OS and a molecular weight of 343.28 g/mol. Its IUPAC name is 3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide
PubChem CID121479881
Molecular FormulaC15H16Cl2N2OS
Molecular Weight343.28 g/mol
Exact Mass342.04
IUPAC Name3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCc1nc2sc(C(=O)NC3(C)CCC3)c(Cl)c2c(C)c1Cl
InChIInChI=1S/C15H16Cl2N2OS/c1-7-9-11(17)12(13(20)19-15(3)5-4-6-15)21-14(9)18-8(2)10(7)16/h4-6H2,1-3H3,(H,19,20)
InChIKeyFVHAHJGZMXCTSV-UHFFFAOYSA-N
XLogP4.89
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.28
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

3-bromo-5-chloro-4,6-dimethyl-N-propan-2-ylthieno[2,3-b]pyridine-2-carboxamide
CID 121479811
5-chloro-N-cyclobutyl-3,4,6-trimethylthieno[2,3-b]pyridine-2-carboxamide
CID 121479860
3-amino-5-chloro-N-cyclopropyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
CID 53382542
2,6-dichloro-N-(1-methylcyclobutyl)pyridine-4-carboxamide
CID 115766201
6-chloro-N-(1-methylcyclobutyl)pyrazine-2-carboxamide
CID 103187308
3-bromo-5-chloro-N,N,4,6-tetramethylthieno[2,3-b]pyridine-2-carboxamide
CID 121479810
5-chloro-N-[1-(4-methoxyphenyl)ethyl]-3,4,6-trimethylthieno[2,3-b]pyridine-2-carboxamide
CID 123870514
3-amino-5-chloro-N-cyclohexyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 53382481
5-chloro-N-cyclobutyl-4,6-dimethyl-3-thiophen-2-ylthieno[2,3-b]pyridine-2-carboxamide
CID 121479876
N-(2-benzoyl-5-chloro-4,6-dimethylthieno[2,3-b]pyridin-3-yl)benzamide
CID 16762602
3-bromo-5-chloro-N-ethyl-N,4,6-trimethylthieno[2,3-b]pyridine-2-carboxamide
CID 121479809
4-amino-2-(diethylamino)-N-(1-methylcyclobutyl)-1,3-thiazole-5-carboxamide
CID 116672673

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide (CID 121479881) is 3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide is Cc1nc2sc(C(=O)NC3(C)CCC3)c(Cl)c2c(C)c1Cl.
What is the InChIKey of 3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is FVHAHJGZMXCTSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2OS/c1-7-9-11(17)12(13(20)19-15(3)5-4-6-15)21-14(9)18-8(2)10(7)16/h4-6H2,1-3H3,(H,19,20).
What are the key properties of 3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide?
3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 343.28 g/mol, XLogP of 4.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-4,6-dimethyl-N-(1-methylcyclobutyl)thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 121479881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).