1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine

C15H24N2OS — CID 63741877

IUPAC1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine
SMILESCNCC1(CN2CCc3sccc3C2)CCCOC1
InChIInChI=1S/C15H24N2OS/c1-16-10-15(5-2-7-18-12-15)11-17-6-3-14-13(9-17)4-8-19-14/h4,8,16H,2-3,5-7,9-12H2,1H3
InChIKeyJQJZWEFNECQJJQ-UHFFFAOYSA-N
MW280.44 g/mol
LogP2.12
Rot. Bonds4

About 1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine

1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine (PubChem CID 63741877) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is 1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine
PubChem CID63741877
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC Name1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine
SMILESCNCC1(CN2CCc3sccc3C2)CCCOC1
InChIInChI=1S/C15H24N2OS/c1-16-10-15(5-2-7-18-12-15)11-17-6-3-14-13(9-17)4-8-19-14/h4,8,16H,2-3,5-7,9-12H2,1H3
InChIKeyJQJZWEFNECQJJQ-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine with MolForge

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Related Compounds

1-[1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)cyclohexyl]-N-methylmethanamine
CID 62262459
N-[[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-4-yl]methyl]ethanamine
CID 62390935
3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxane-3-carboxylic acid
CID 55241474
N-methyl-1-[3-[(4-propylpiperazin-1-yl)methyl]oxan-3-yl]methanamine
CID 63741691
N-methyl-1-[3-[(3-methylpyrrolidin-1-yl)methyl]oxan-3-yl]methanamine
CID 63740313
2-[4-[[3-(methylaminomethyl)oxan-3-yl]methyl]-1,4-diazepan-1-yl]ethanol
CID 107226535
N-methyl-1-[3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]oxan-3-yl]methanamine
CID 63740113
1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine
CID 63740106
5-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methylpentan-1-amine
CID 62437630
N-methyl-1-[1-(1,3,4,5-tetrahydro-2-benzazepin-2-ylmethyl)cyclohexyl]methanamine
CID 63153211
1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)cyclopentane-1-carbaldehyde
CID 62277127
[1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine
CID 104678673

Frequently Asked Questions

What is the IUPAC name of 1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine (CID 63741877) is 1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine is CNCC1(CN2CCc3sccc3C2)CCCOC1.
What is the InChIKey of 1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine?
The InChIKey is JQJZWEFNECQJJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-16-10-15(5-2-7-18-12-15)11-17-6-3-14-13(9-17)4-8-19-14/h4,8,16H,2-3,5-7,9-12H2,1H3.
What are the key properties of 1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine?
1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine has a molecular weight of 280.44 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)oxan-3-yl]-N-methylmethanamine is sourced from PubChem (CID 63741877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).