(4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole

C8H13NS — CID 143927595

IUPAC(4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole
SMILESCC/C=C1\N=C(C)SC1C
InChIInChI=1S/C8H13NS/c1-4-5-8-6(2)10-7(3)9-8/h5-6H,4H2,1-3H3/b8-5-
InChIKeyFDEZZOYYVSUNEB-YVMONPNESA-N
MW155.27 g/mol
LogP2.83
Rot. Bonds1

About (4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole

(4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole (PubChem CID 143927595) has the molecular formula C8H13NS and a molecular weight of 155.27 g/mol. Its IUPAC name is (4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole.

Molecular Properties

Compound Name(4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole
PubChem CID143927595
Molecular FormulaC8H13NS
Molecular Weight155.27 g/mol
Exact Mass155.08
IUPAC Name(4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole
SMILESCC/C=C1\N=C(C)SC1C
InChIInChI=1S/C8H13NS/c1-4-5-8-6(2)10-7(3)9-8/h5-6H,4H2,1-3H3/b8-5-
InChIKeyFDEZZOYYVSUNEB-YVMONPNESA-N
XLogP2.83
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.27
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-tert-butyl-2-(2,2-dimethylpropylsulfanyl)-3H-pyrrole
CID 58263466
6-Methyl-2,4-bis(methylsulfanyl)-3,4-dihydropyridine
CID 59897658
(4E)-2-methyl-4-[(Z)-pent-2-enylidene]-1,3-thiazole
CID 88944830
(2E)-2-[(4E)-2-methyl-4-propylidene-1,3-thiazol-5-ylidene]ethanethiol
CID 89029305
(4E)-4-ethylidene-2-methyl-5-prop-2-enyl-1,3-thiazole
CID 89367556
2,4,5-Trimethyl-1-prop-2-enyl-1,3-thiazol-1-ium
CID 90932149
2-Methyl-5-(2-methylbut-2-enylidene)-4-methylidene-1,3-thiazole
CID 123191476
(4E,5E)-2-methyl-4,5-di(propylidene)-1,3-thiazole
CID 126659416
CID 141784496
CID 141784496
(4E,5E)-4-ethylidene-2-methyl-5-propylidene-1,3-thiazole
CID 142178506
(4E)-2-methyl-5-methylidene-4-[(Z)-pent-3-enylidene]-1,3-thiazole
CID 142863076
(5E)-2-methyl-5-[(E)-2-methylbut-2-enylidene]-4-methylidene-1,3-thiazole
CID 142967454

Frequently Asked Questions

What is the IUPAC name of (4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole?
The IUPAC name of (4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole (CID 143927595) is (4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole.
What is the SMILES notation for (4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole?
The canonical SMILES for (4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole is CC/C=C1\N=C(C)SC1C.
What is the InChIKey of (4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole?
The InChIKey is FDEZZOYYVSUNEB-YVMONPNESA-N. The full InChI is InChI=1S/C8H13NS/c1-4-5-8-6(2)10-7(3)9-8/h5-6H,4H2,1-3H3/b8-5-.
What are the key properties of (4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole?
(4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole has a molecular weight of 155.27 g/mol, XLogP of 2.83, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-2,5-dimethyl-4-propylidene-1,3-thiazole is sourced from PubChem (CID 143927595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).