ethane;4-propan-2-yl-1,2-thiazole

C10H21NS — CID 142062830

IUPACethane;4-propan-2-yl-1,2-thiazole
SMILESCC.CC.CC(C)c1cnsc1
InChIInChI=1S/C6H9NS.2C2H6/c1-5(2)6-3-7-8-4-6;2*1-2/h3-5H,1-2H3;2*1-2H3
InChIKeyMMCRWPYDXZBIQH-UHFFFAOYSA-N
MW187.35 g/mol
LogP4.32
Rot. Bonds1

About ethane;4-propan-2-yl-1,2-thiazole

ethane;4-propan-2-yl-1,2-thiazole (PubChem CID 142062830) has the molecular formula C10H21NS and a molecular weight of 187.35 g/mol. Its IUPAC name is ethane;4-propan-2-yl-1,2-thiazole.

Molecular Properties

Compound Nameethane;4-propan-2-yl-1,2-thiazole
PubChem CID142062830
Molecular FormulaC10H21NS
Molecular Weight187.35 g/mol
Exact Mass187.14
IUPAC Nameethane;4-propan-2-yl-1,2-thiazole
SMILESCC.CC.CC(C)c1cnsc1
InChIInChI=1S/C6H9NS.2C2H6/c1-5(2)6-3-7-8-4-6;2*1-2/h3-5H,1-2H3;2*1-2H3
InChIKeyMMCRWPYDXZBIQH-UHFFFAOYSA-N
XLogP4.32
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.35
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;4-propan-2-yl-1,2-thiazole 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

cumene;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,2-thiazole;2-propan-2-ylthiophene;3-propan-2-ylthiophene
CID 158764841
4-undecan-5-yl-1,2-thiazole
CID 146406991
4-[1-[2,6-di(propan-2-yl)purin-9-yl]ethyl]-1,2-thiazole
CID 176927861
1-(1,2-thiazol-4-yloxy)ethanamine
CID 117230048
4-(2-methylpropoxy)-1,2-thiazole
CID 117233613
ethane;2-fluoro-5-propan-2-ylpyrimidine
CID 178173609
5-propan-2-ylpyridine-2-sulfonyl chloride
CID 22281918
cumene;ethane
CID 54306132
magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide
CID 175275405
CID 175757661
CID 175757661
ethane;methane;3-propan-2-ylpyridine;sulfane
CID 159647027
3-tert-butyl-5-propan-2-ylpyridine;ethane
CID 162747621

Frequently Asked Questions

What is the IUPAC name of ethane;4-propan-2-yl-1,2-thiazole?
The IUPAC name of ethane;4-propan-2-yl-1,2-thiazole (CID 142062830) is ethane;4-propan-2-yl-1,2-thiazole.
What is the SMILES notation for ethane;4-propan-2-yl-1,2-thiazole?
The canonical SMILES for ethane;4-propan-2-yl-1,2-thiazole is CC.CC.CC(C)c1cnsc1.
What is the InChIKey of ethane;4-propan-2-yl-1,2-thiazole?
The InChIKey is MMCRWPYDXZBIQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NS.2C2H6/c1-5(2)6-3-7-8-4-6;2*1-2/h3-5H,1-2H3;2*1-2H3.
What are the key properties of ethane;4-propan-2-yl-1,2-thiazole?
ethane;4-propan-2-yl-1,2-thiazole has a molecular weight of 187.35 g/mol, XLogP of 4.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-propan-2-yl-1,2-thiazole is sourced from PubChem (CID 142062830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).