5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride

C14H14ClNOS — CID 11369487

IUPAC5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride
SMILESCOc1ccc2c(c1)CC/C2=C/c1cncs1.Cl
InChIInChI=1S/C14H13NOS.ClH/c1-16-12-4-5-14-10(6-12)2-3-11(14)7-13-8-15-9-17-13;/h4-9H,2-3H2,1H3;1H/b11-7-;
InChIKeyYRFLVWWXCPHCSV-AJULUCINSA-N
MW279.79 g/mol
LogP4.06
Rot. Bonds2

About 5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride

5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride (PubChem CID 11369487) has the molecular formula C14H14ClNOS and a molecular weight of 279.79 g/mol. Its IUPAC name is 5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride.

Molecular Properties

Compound Name5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride
PubChem CID11369487
Molecular FormulaC14H14ClNOS
Molecular Weight279.79 g/mol
Exact Mass279.05
IUPAC Name5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride
SMILESCOc1ccc2c(c1)CC/C2=C/c1cncs1.Cl
InChIInChI=1S/C14H13NOS.ClH/c1-16-12-4-5-14-10(6-12)2-3-11(14)7-13-8-15-9-17-13;/h4-9H,2-3H2,1H3;1H/b11-7-;
InChIKeyYRFLVWWXCPHCSV-AJULUCINSA-N
XLogP4.06
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.79
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 11210966
CID 11210966
2-[(5-bromothiophen-2-yl)methylidene]-6-methoxy-3,4-dihydronaphthalen-1-one
CID 5147496
(2E)-2-(5-methoxy-2,3-dihydroinden-1-ylidene)acetamide
CID 10888983
(2E)-2-(5-methoxy-2,3-dihydroinden-1-ylidene)-N,N-dimethylethanamine
CID 176832118
2-[(2-hydroxy-4-methoxyphenyl)methylidene]-6-methoxy-3,4-dihydronaphthalen-1-one
CID 165342146
3-[2-(ethoxymethoxy)ethylidene]-6-methoxy-1,2-dihydroindene
CID 91068807
6-methoxy-N-(1,3-thiazol-5-ylmethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115732237
(6E)-6-(1,3-thiazol-5-ylmethylidene)-8,9-dihydro-7H-benzo[7]annulen-5-one
CID 166225079
2-(5-methoxy-2,3-dihydroinden-1-ylidene)ethyl acetate
CID 174994017
(2E)-2-[(2-chloro-4-methylphenyl)methylidene]-6-methoxy-3,4-dihydronaphthalen-1-one
CID 58465465
1-(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)propan-1-amine
CID 61336437
6-methoxy-2-[(4-propan-2-ylphenyl)methylidene]-3,4-dihydronaphthalen-1-one
CID 2738104

Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride?
The IUPAC name of 5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride (CID 11369487) is 5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride.
What is the SMILES notation for 5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride?
The canonical SMILES for 5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride is COc1ccc2c(c1)CC/C2=C/c1cncs1.Cl.
What is the InChIKey of 5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride?
The InChIKey is YRFLVWWXCPHCSV-AJULUCINSA-N. The full InChI is InChI=1S/C14H13NOS.ClH/c1-16-12-4-5-14-10(6-12)2-3-11(14)7-13-8-15-9-17-13;/h4-9H,2-3H2,1H3;1H/b11-7-;.
What are the key properties of 5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride?
5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride has a molecular weight of 279.79 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-(5-methoxy-2,3-dihydroinden-1-ylidene)methyl]-1,3-thiazole;hydrochloride is sourced from PubChem (CID 11369487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).