2-methyl-5-propyl-2,3-dihydro-1,3-thiazole

C7H13NS — CID 126515491

IUPAC2-methyl-5-propyl-2,3-dihydro-1,3-thiazole
SMILESCCCC1=CNC(C)S1
InChIInChI=1S/C7H13NS/c1-3-4-7-5-8-6(2)9-7/h5-6,8H,3-4H2,1-2H3
InChIKeyWOUKOFOPIJDERL-UHFFFAOYSA-N
MW143.25 g/mol
LogP2.31
Rot. Bonds2

About 2-methyl-5-propyl-2,3-dihydro-1,3-thiazole

2-methyl-5-propyl-2,3-dihydro-1,3-thiazole (PubChem CID 126515491) has the molecular formula C7H13NS and a molecular weight of 143.25 g/mol. Its IUPAC name is 2-methyl-5-propyl-2,3-dihydro-1,3-thiazole.

Molecular Properties

Compound Name2-methyl-5-propyl-2,3-dihydro-1,3-thiazole
PubChem CID126515491
Molecular FormulaC7H13NS
Molecular Weight143.25 g/mol
Exact Mass143.08
IUPAC Name2-methyl-5-propyl-2,3-dihydro-1,3-thiazole
SMILESCCCC1=CNC(C)S1
InChIInChI=1S/C7H13NS/c1-3-4-7-5-8-6(2)9-7/h5-6,8H,3-4H2,1-2H3
InChIKeyWOUKOFOPIJDERL-UHFFFAOYSA-N
XLogP2.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.25
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Ethyl-2-fluoro-2,3-dihydro-1,3-thiazole
CID 146392776
2,5-Di(propan-2-yl)-2,3-dihydro-1,3-thiazole
CID 58092319
2-propylsulfanyl-2,3-dihydro-1H-pyrrole
CID 70438663
2,5-Dimethyl-2,3-dihydro-1,3-thiazole
CID 89076192
N-methyl-1-(thiolan-2-ylidene)methanamine
CID 91211644
5-Ethyl-2,3-dihydro-1,3-thiazole
CID 117713740
1-(2-Methyl-2,3-dihydro-1,3-thiazol-5-yl)propan-1-amine
CID 141810372
2,5-Dimethyl-2,3-dihydro-1,3-thiazole;hydroiodide
CID 141830701
Ethane;5-ethyl-2,3-dihydro-1,3-thiazole
CID 141879050
2,5-Dimethyl-2,3-dihydro-1,3-thiazole;ethane
CID 141880596
Ethane;5-ethyl-2-methyl-2,3-dihydro-1,3-thiazole
CID 143886033
5-Ethyl-2-methyl-2,3-dihydro-1,3-thiazole
CID 143886034

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-propyl-2,3-dihydro-1,3-thiazole?
The IUPAC name of 2-methyl-5-propyl-2,3-dihydro-1,3-thiazole (CID 126515491) is 2-methyl-5-propyl-2,3-dihydro-1,3-thiazole.
What is the SMILES notation for 2-methyl-5-propyl-2,3-dihydro-1,3-thiazole?
The canonical SMILES for 2-methyl-5-propyl-2,3-dihydro-1,3-thiazole is CCCC1=CNC(C)S1.
What is the InChIKey of 2-methyl-5-propyl-2,3-dihydro-1,3-thiazole?
The InChIKey is WOUKOFOPIJDERL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NS/c1-3-4-7-5-8-6(2)9-7/h5-6,8H,3-4H2,1-2H3.
What are the key properties of 2-methyl-5-propyl-2,3-dihydro-1,3-thiazole?
2-methyl-5-propyl-2,3-dihydro-1,3-thiazole has a molecular weight of 143.25 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-propyl-2,3-dihydro-1,3-thiazole is sourced from PubChem (CID 126515491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).