4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine

C14H15ClN2S — CID 13210725

IUPAC4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine
SMILESCN1Cc2sc(N)cc2C(c2ccc(Cl)cc2)C1
InChIInChI=1S/C14H15ClN2S/c1-17-7-12(9-2-4-10(15)5-3-9)11-6-14(16)18-13(11)8-17/h2-6,12H,7-8,16H2,1H3
InChIKeyXBQLTAVVMUKUQK-UHFFFAOYSA-N
MW278.81 g/mol
LogP3.56
Rot. Bonds1

About 4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine

4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine (PubChem CID 13210725) has the molecular formula C14H15ClN2S and a molecular weight of 278.81 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine.

Molecular Properties

Compound Name4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine
PubChem CID13210725
Molecular FormulaC14H15ClN2S
Molecular Weight278.81 g/mol
Exact Mass278.06
IUPAC Name4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine
SMILESCN1Cc2sc(N)cc2C(c2ccc(Cl)cc2)C1
InChIInChI=1S/C14H15ClN2S/c1-17-7-12(9-2-4-10(15)5-3-9)11-6-14(16)18-13(11)8-17/h2-6,12H,7-8,16H2,1H3
InChIKeyXBQLTAVVMUKUQK-UHFFFAOYSA-N
XLogP3.56
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.81
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine?
The IUPAC name of 4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine (CID 13210725) is 4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine.
What is the SMILES notation for 4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine?
The canonical SMILES for 4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine is CN1Cc2sc(N)cc2C(c2ccc(Cl)cc2)C1.
What is the InChIKey of 4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine?
The InChIKey is XBQLTAVVMUKUQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2S/c1-17-7-12(9-2-4-10(15)5-3-9)11-6-14(16)18-13(11)8-17/h2-6,12H,7-8,16H2,1H3.
What are the key properties of 4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine?
4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine has a molecular weight of 278.81 g/mol, XLogP of 3.56, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine is sourced from PubChem (CID 13210725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).