2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole

C7H11NS — CID 142099508

IUPAC2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole
SMILESC/C=C\C1=CSC(C)N1
InChIInChI=1S/C7H11NS/c1-3-4-7-5-9-6(2)8-7/h3-6,8H,1-2H3/b4-3-
InChIKeyYVQXSRJVQUTSKP-ARJAWSKDSA-N
MW141.24 g/mol
LogP2.09
Rot. Bonds1

About 2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole

2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole (PubChem CID 142099508) has the molecular formula C7H11NS and a molecular weight of 141.24 g/mol. Its IUPAC name is 2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole.

Molecular Properties

Compound Name2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole
PubChem CID142099508
Molecular FormulaC7H11NS
Molecular Weight141.24 g/mol
Exact Mass141.06
IUPAC Name2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole
SMILESC/C=C\C1=CSC(C)N1
InChIInChI=1S/C7H11NS/c1-3-4-7-5-9-6(2)8-7/h3-6,8H,1-2H3/b4-3-
InChIKeyYVQXSRJVQUTSKP-ARJAWSKDSA-N
XLogP2.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.24
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-Dimethyl-2,3-dihydro-1,3-thiazole
CID 22103430
2-Methylsulfanyl-1,2-dihydropyridine
CID 22928846
2-methylsulfanyl-2,5-dihydro-1H-pyrrole
CID 58653710
6-Methyl-1-(2-methylsulfanylethyl)-1,2-dihydropyridin-1-ium
CID 59893090
N-methyl-2H-thiopyran-4-amine
CID 70273602
(2E,4Z)-2-methylsulfanyl-N-prop-1-en-2-ylhexa-2,4-dien-1-amine
CID 89088796
4-Ethenyl-2-methyl-2,3-dihydro-1,3-thiazole
CID 89097205
3-ethenyl-2-[(Z)-prop-1-enyl]-4H-1,4-thiazine
CID 89176393
(2Z,4Z)-N-[2-(disulfanyl)ethyl]hexa-2,4-dien-2-amine
CID 89328144
5-ethenyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole
CID 121275139
(2E)-N-ethenyl-4-methylsulfanylpenta-2,4-dien-2-amine
CID 126584050
(3Z,5E)-5-methylsulfanyl-N-[(E)-prop-1-enyl]hepta-1,3,5-trien-2-amine
CID 129144376

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole?
The IUPAC name of 2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole (CID 142099508) is 2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole.
What is the SMILES notation for 2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole?
The canonical SMILES for 2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole is C/C=C\C1=CSC(C)N1.
What is the InChIKey of 2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole?
The InChIKey is YVQXSRJVQUTSKP-ARJAWSKDSA-N. The full InChI is InChI=1S/C7H11NS/c1-3-4-7-5-9-6(2)8-7/h3-6,8H,1-2H3/b4-3-.
What are the key properties of 2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole?
2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole has a molecular weight of 141.24 g/mol, XLogP of 2.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-thiazole is sourced from PubChem (CID 142099508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).