2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane

C10H21NS — CID 145152017

IUPAC2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane
SMILESCC.CC1=C(C(C)C)SC(C)N1
InChIInChI=1S/C8H15NS.C2H6/c1-5(2)8-6(3)9-7(4)10-8;1-2/h5,7,9H,1-4H3;1-2H3
InChIKeyWEDIZWBYSWFOJI-UHFFFAOYSA-N
MW187.35 g/mol
LogP3.58
Rot. Bonds1

About 2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane

2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane (PubChem CID 145152017) has the molecular formula C10H21NS and a molecular weight of 187.35 g/mol. Its IUPAC name is 2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane.

Molecular Properties

Compound Name2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane
PubChem CID145152017
Molecular FormulaC10H21NS
Molecular Weight187.35 g/mol
Exact Mass187.14
IUPAC Name2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane
SMILESCC.CC1=C(C(C)C)SC(C)N1
InChIInChI=1S/C8H15NS.C2H6/c1-5(2)8-6(3)9-7(4)10-8;1-2/h5,7,9H,1-4H3;1-2H3
InChIKeyWEDIZWBYSWFOJI-UHFFFAOYSA-N
XLogP3.58
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.35
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Tert-butyl-2-methyl-4-(trifluoromethyl)-2,3-dihydro-1,3-thiazole
CID 58027289
2-Isopropyl-3-isobutyl-5,6-dihydro-4H-1,4-thiazin
CID 12998653
4,5-Dimethyl-2-propan-2-yl-2,3-dihydro-1,3-thiazole
CID 23384098
4,5-Di(propan-2-yl)-2,3-dihydro-1,3-thiazole
CID 57632394
5,6-di(propan-2-yl)-3,4-dihydro-2H-1,4-thiazine
CID 57632397
2,4-Dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole
CID 58359101
(2S)-4,5-dimethyl-2-propan-2-yl-2,3-dihydro-1,3-thiazole
CID 59954979
5-Tert-butyl-4-methyl-2,3-dihydro-1,3-thiazole
CID 89007710
6-methyl-5-propan-2-yl-3,4-dihydro-2H-1,4-thiazine
CID 89036740
5-methyl-6-propan-2-yl-3,4-dihydro-2H-1,4-thiazine
CID 89041216
4-Butan-2-yl-2,5-dimethyl-2,3-dihydro-1,3-thiazole
CID 130420194
5-Ethyl-2-methyl-4-propyl-2,3-dihydro-1,3-thiazole
CID 132196857

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane?
The IUPAC name of 2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane (CID 145152017) is 2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane.
What is the SMILES notation for 2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane?
The canonical SMILES for 2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane is CC.CC1=C(C(C)C)SC(C)N1.
What is the InChIKey of 2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane?
The InChIKey is WEDIZWBYSWFOJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NS.C2H6/c1-5(2)8-6(3)9-7(4)10-8;1-2/h5,7,9H,1-4H3;1-2H3.
What are the key properties of 2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane?
2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane has a molecular weight of 187.35 g/mol, XLogP of 3.58, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-5-propan-2-yl-2,3-dihydro-1,3-thiazole;ethane is sourced from PubChem (CID 145152017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).