(Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol

C11H15NOS — CID 163583514

IUPAC(Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol
SMILESC/C=C(\O)c1cc2c(s1)CCN(C)C2
InChIInChI=1S/C11H15NOS/c1-3-9(13)11-6-8-7-12(2)5-4-10(8)14-11/h3,6,13H,4-5,7H2,1-2H3/b9-3-
InChIKeyGJOIQYDSMQFXCG-OQFOIZHKSA-N
MW209.31 g/mol
LogP2.65
Rot. Bonds1

About (Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol

(Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol (PubChem CID 163583514) has the molecular formula C11H15NOS and a molecular weight of 209.31 g/mol. Its IUPAC name is (Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol.

Molecular Properties

Compound Name(Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol
PubChem CID163583514
Molecular FormulaC11H15NOS
Molecular Weight209.31 g/mol
Exact Mass209.09
IUPAC Name(Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol
SMILESC/C=C(\O)c1cc2c(s1)CCN(C)C2
InChIInChI=1S/C11H15NOS/c1-3-9(13)11-6-8-7-12(2)5-4-10(8)14-11/h3,6,13H,4-5,7H2,1-2H3/b9-3-
InChIKeyGJOIQYDSMQFXCG-OQFOIZHKSA-N
XLogP2.65
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Analyze (Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol with MolForge

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Related Compounds

5-methyl-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxylic acid;hydrochloride
CID 122236295
(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl) acetate
CID 118203485
(6E)-6-[(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)methylidene]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
CID 46182439
2-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)propanenitrile
CID 84779244
5-(1-carboxyethyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-2-carboxylic acid
CID 82369206
2-bromo-5-methyl-4,6,7,8-tetrahydrothieno[3,2-c]azepine
CID 82384737
5-benzoyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-2-carboxylic acid
CID 82369269
5-(2,2,2-trifluoroacetyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-2-carboxylic acid
CID 82369281
5-(4-methylbenzoyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-2-carboxylic acid
CID 82369272
benzene;buta-1,3-diene;2,7-dimethyl-3,4-dihydro-1H-isoquinoline;prop-1-ene
CID 155698278
5-(2,3-dihydroxypropyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-2-carboxylic acid
CID 82369235
5-methyl-2-piperidin-4-yl-4,6,7,8-tetrahydrothieno[3,2-c]azepine
CID 82382650

Frequently Asked Questions

What is the IUPAC name of (Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol?
The IUPAC name of (Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol (CID 163583514) is (Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol.
What is the SMILES notation for (Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol?
The canonical SMILES for (Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol is C/C=C(\O)c1cc2c(s1)CCN(C)C2.
What is the InChIKey of (Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol?
The InChIKey is GJOIQYDSMQFXCG-OQFOIZHKSA-N. The full InChI is InChI=1S/C11H15NOS/c1-3-9(13)11-6-8-7-12(2)5-4-10(8)14-11/h3,6,13H,4-5,7H2,1-2H3/b9-3-.
What are the key properties of (Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol?
(Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol has a molecular weight of 209.31 g/mol, XLogP of 2.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-(5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl)prop-1-en-1-ol is sourced from PubChem (CID 163583514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).