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

C14H15BrN2S — CID 13210728

IUPAC4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine
SMILESCN1Cc2sc(N)cc2C(c2ccc(Br)cc2)C1
InChIInChI=1S/C14H15BrN2S/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
InChIKeyONPDRABXOZIZLB-UHFFFAOYSA-N
MW323.26 g/mol
LogP3.67
Rot. Bonds1

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

4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine (PubChem CID 13210728) has the molecular formula C14H15BrN2S and a molecular weight of 323.26 g/mol. Its IUPAC name is 4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine.

Molecular Properties

Compound Name4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine
PubChem CID13210728
Molecular FormulaC14H15BrN2S
Molecular Weight323.26 g/mol
Exact Mass322.01
IUPAC Name4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine
SMILESCN1Cc2sc(N)cc2C(c2ccc(Br)cc2)C1
InChIInChI=1S/C14H15BrN2S/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
InChIKeyONPDRABXOZIZLB-UHFFFAOYSA-N
XLogP3.67
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.26
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-Dimethyl-4-(p-bromophenyl)-4,5,6,7-tetrahydro-thieno[2,3-c]pyridine hydrochloride
CID 20546707
2-Methyl-4-(p-bromophenyl)-4,5,6,7-tetrahydro-thieno[2,3-c]pyridine hydrochloride
CID 20546729
4-(4-bromophenyl)-6-methyl-2-nitro-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
CID 54586590
4-(4-bromophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
CID 54587606
2-bromo-4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine
CID 20546719
2,6-Dimethyl-3-bromo-4-(p-bromophenyl)-4,5,6,7-tetrahydro-thieno[2,3-c]pyridine hydrochloride
CID 20546728
4-(4-Bromophenyl)-2,4,6-trimethyl-5,7-dihydrothieno[2,3-c]pyridine
CID 44270321
4-(4-bromophenyl)-2-tert-butyl-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
CID 54582718
2-bromo-6-methyl-4-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
CID 54583695
4-(4-Bromophenyl)-4-ethyl-2,6-dimethyl-5,7-dihydrothieno[2,3-c]pyridine
CID 44270320
4-(4-bromophenyl)-6-methyl-2-nitro-5,7-dihydro-4H-thieno[2,3-c]pyridine
CID 13210722
4-(4-bromophenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine
CID 20261494

Frequently Asked Questions

What is the IUPAC name of 4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine?
The IUPAC name of 4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine (CID 13210728) is 4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine.
What is the SMILES notation for 4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine?
The canonical SMILES for 4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine is CN1Cc2sc(N)cc2C(c2ccc(Br)cc2)C1.
What is the InChIKey of 4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine?
The InChIKey is ONPDRABXOZIZLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2S/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-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine?
4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine has a molecular weight of 323.26 g/mol, XLogP of 3.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-bromophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine is sourced from PubChem (CID 13210728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).