5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole

C10H17NS — CID 130511938

IUPAC5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole
SMILESCCCc1nc(C(C)C)c(C)s1
InChIInChI=1S/C10H17NS/c1-5-6-9-11-10(7(2)3)8(4)12-9/h7H,5-6H2,1-4H3
InChIKeyGMPADQREBLMOQC-UHFFFAOYSA-N
MW183.32 g/mol
LogP3.53
Rot. Bonds3

About 5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole

5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole (PubChem CID 130511938) has the molecular formula C10H17NS and a molecular weight of 183.32 g/mol. Its IUPAC name is 5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole.

Molecular Properties

Compound Name5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole
PubChem CID130511938
Molecular FormulaC10H17NS
Molecular Weight183.32 g/mol
Exact Mass183.11
IUPAC Name5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole
SMILESCCCc1nc(C(C)C)c(C)s1
InChIInChI=1S/C10H17NS/c1-5-6-9-11-10(7(2)3)8(4)12-9/h7H,5-6H2,1-4H3
InChIKeyGMPADQREBLMOQC-UHFFFAOYSA-N
XLogP3.53
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.32
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(chloromethyl)-5-methyl-4-propan-2-yl-1,3-thiazole
CID 62923237
2-methyl-N-[(4-propan-2-yl-2-propyl-1,3-thiazol-5-yl)methyl]propan-1-amine
CID 82433844
N-ethyl-4-(4-propan-2-yl-2-propyl-1,3-thiazol-5-yl)-1,3-thiazol-2-amine
CID 82433869
methyl 5-methyl-2-propyl-1,3-thiazole-4-carboxylate
CID 115422950
ethyl 5-methyl-2-propyl-1,3-thiazole-4-carboxylate
CID 116526179
N-[[4-(2-methylpropyl)-2-propyl-1,3-thiazol-5-yl]methyl]ethanamine
CID 114368491
N-[[2-(2-methylpropyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]ethanamine
CID 82434587
N'-methyl-N-[(5-methyl-4-propan-2-yl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboximidamide
CID 119129397
N-[[4-propan-2-yl-2-(3,3,3-trifluoropropyl)-1,3-thiazol-5-yl]methyl]ethanamine
CID 114365128
2-ethyl-5-methoxy-4-propan-2-yl-1,3-thiazole
CID 174404284
2-[(5-methyl-4-propan-2-yl-1,3-thiazol-2-yl)methyl]-1-phenylguanidine
CID 119147362
N-[(4-ethyl-2-propyl-1,3-thiazol-5-yl)methyl]butan-2-amine
CID 82428480

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole?
The IUPAC name of 5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole (CID 130511938) is 5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole.
What is the SMILES notation for 5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole?
The canonical SMILES for 5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole is CCCc1nc(C(C)C)c(C)s1.
What is the InChIKey of 5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole?
The InChIKey is GMPADQREBLMOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NS/c1-5-6-9-11-10(7(2)3)8(4)12-9/h7H,5-6H2,1-4H3.
What are the key properties of 5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole?
5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole has a molecular weight of 183.32 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-propan-2-yl-2-propyl-1,3-thiazole is sourced from PubChem (CID 130511938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).