3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine

C18H24N2S — CID 62618249

IUPAC3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine
SMILESCc1ccc(C(N)CCN2CCc3sccc3C2C)cc1
InChIInChI=1S/C18H24N2S/c1-13-3-5-15(6-4-13)17(19)7-10-20-11-8-18-16(14(20)2)9-12-21-18/h3-6,9,12,14,17H,7-8,10-11,19H2,1-2H3
InChIKeyFJINWDKJRBYMBG-UHFFFAOYSA-N
MW300.47 g/mol
LogP4.07
Rot. Bonds4

About 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine

3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine (PubChem CID 62618249) has the molecular formula C18H24N2S and a molecular weight of 300.47 g/mol. Its IUPAC name is 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine.

Molecular Properties

Compound Name3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine
PubChem CID62618249
Molecular FormulaC18H24N2S
Molecular Weight300.47 g/mol
Exact Mass300.17
IUPAC Name3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine
SMILESCc1ccc(C(N)CCN2CCc3sccc3C2C)cc1
InChIInChI=1S/C18H24N2S/c1-13-3-5-15(6-4-13)17(19)7-10-20-11-8-18-16(14(20)2)9-12-21-18/h3-6,9,12,14,17H,7-8,10-11,19H2,1-2H3
InChIKeyFJINWDKJRBYMBG-UHFFFAOYSA-N
XLogP4.07
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.47
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine with MolForge

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Related Compounds

1-(4-bromophenyl)-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-ol
CID 62619347
2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-thiophen-2-ylethanamine
CID 115287790
2,2-dimethyl-4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)butanenitrile
CID 65251827
2-[2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]aniline
CID 55079205
2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetonitrile
CID 60699782
2-[3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propyl]aniline
CID 107274405
4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)butanehydrazide
CID 63585229
2-methyl-1-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pentan-2-amine
CID 55008664
2-cyclopropyl-1-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-2-amine
CID 55009206
5-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pentanimidamide
CID 55010853
[6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine
CID 106906070
(2S)-1-[(4R)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-3-pyrazol-1-ylpropan-2-ol
CID 94391754

Frequently Asked Questions

What is the IUPAC name of 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine?
The IUPAC name of 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine (CID 62618249) is 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine.
What is the SMILES notation for 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine?
The canonical SMILES for 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine is Cc1ccc(C(N)CCN2CCc3sccc3C2C)cc1.
What is the InChIKey of 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine?
The InChIKey is FJINWDKJRBYMBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2S/c1-13-3-5-15(6-4-13)17(19)7-10-20-11-8-18-16(14(20)2)9-12-21-18/h3-6,9,12,14,17H,7-8,10-11,19H2,1-2H3.
What are the key properties of 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine?
3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine has a molecular weight of 300.47 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(4-methylphenyl)propan-1-amine is sourced from PubChem (CID 62618249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).