1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine

C9H13NOS — CID 53237585

IUPAC1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine
SMILESCNC[C@@H]1OCCc2sccc21
InChIInChI=1S/C9H13NOS/c1-10-6-8-7-3-5-12-9(7)2-4-11-8/h3,5,8,10H,2,4,6H2,1H3/t8-/m0/s1
InChIKeyWOBIRCYOVUUDGG-QMMMGPOBSA-N
MW183.28 g/mol
LogP1.58
Rot. Bonds2

About 1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine

1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine (PubChem CID 53237585) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is 1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine
PubChem CID53237585
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC Name1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine
SMILESCNC[C@@H]1OCCc2sccc21
InChIInChI=1S/C9H13NOS/c1-10-6-8-7-3-5-12-9(7)2-4-11-8/h3,5,8,10H,2,4,6H2,1H3/t8-/m0/s1
InChIKeyWOBIRCYOVUUDGG-QMMMGPOBSA-N
XLogP1.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Ulotaront
CID 89532783
6,7-Dihydro-N-methyl-4H-thieno[3,4-c]pyran-4-methanamine
CID 53239199
2-[(7S)-5,7-dihydro-4H-thieno[2,3-c]pyran-7-yl]ethanamine
CID 67258500
(Rac)-SEP-363856
CID 68335002
1-[(7R)-5,7-dihydro-4H-thieno[2,3-c]pyran-7-yl]-N-methylmethanamine
CID 89532773
[(7s)-4h,5h,7h-Thieno[2,3-c]pyran-7-yl]methanamine
CID 89532776
Ulotaront Hydrochloride
CID 139415154
N-methyl-1-(4,5,6,8-tetrahydrothieno[2,3-c]oxepin-8-yl)methanamine
CID 166625859
4,5,6,8-Tetrahydrothieno[2,3-c]oxepin-8-ylmethanamine
CID 166627175
1-[(7S)-5,7-dihydro-4H-thieno[2,3-c]pyran-7-yl]-N,N-dimethylmethanamine
CID 166631571
4,5a,6,7,8,9a-Hexahydro-5H-9-oxa-3-thia-6-aza-cyclopenta[a]naphthalene
CID 44333746
1-[[(7S)-5,7-dihydro-4H-thieno[2,3-c]pyran-7-yl]methyl]pyrrolidine
CID 166632665

Frequently Asked Questions

What is the IUPAC name of 1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine (CID 53237585) is 1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine is CNC[C@@H]1OCCc2sccc21.
What is the InChIKey of 1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine?
The InChIKey is WOBIRCYOVUUDGG-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H13NOS/c1-10-6-8-7-3-5-12-9(7)2-4-11-8/h3,5,8,10H,2,4,6H2,1H3/t8-/m0/s1.
What are the key properties of 1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine?
1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine has a molecular weight of 183.28 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-methylmethanamine is sourced from PubChem (CID 53237585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).