4-butyl-5-propyl-1,3-thiazol-2-amine

C10H18N2S — CID 23585837

IUPAC4-butyl-5-propyl-1,3-thiazol-2-amine
SMILESCCCCc1nc(N)sc1CCC
InChIInChI=1S/C10H18N2S/c1-3-5-7-8-9(6-4-2)13-10(11)12-8/h3-7H2,1-2H3,(H2,11,12)
InChIKeyZNFBTPMYWAYKSL-UHFFFAOYSA-N
MW198.33 g/mol
LogP3.02
Rot. Bonds5

About 4-butyl-5-propyl-1,3-thiazol-2-amine

4-butyl-5-propyl-1,3-thiazol-2-amine (PubChem CID 23585837) has the molecular formula C10H18N2S and a molecular weight of 198.33 g/mol. Its IUPAC name is 4-butyl-5-propyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-butyl-5-propyl-1,3-thiazol-2-amine
PubChem CID23585837
Molecular FormulaC10H18N2S
Molecular Weight198.33 g/mol
Exact Mass198.12
IUPAC Name4-butyl-5-propyl-1,3-thiazol-2-amine
SMILESCCCCc1nc(N)sc1CCC
InChIInChI=1S/C10H18N2S/c1-3-5-7-8-9(6-4-2)13-10(11)12-8/h3-7H2,1-2H3,(H2,11,12)
InChIKeyZNFBTPMYWAYKSL-UHFFFAOYSA-N
XLogP3.02
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.33
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-4,5,6,7-tetrahydrobenzothiazole
CID 18046
Amthamine
CID 126688
4,5,6,7-Tetrahydro-1,3-benzothiazol-2-amine hydroiodide
CID 11580040
3,4,5,6-Tetrahydro-2H-cyclopenta(d)(1,3)thiazol-2-imine
CID 332255
4-Ethyl-5-methyl-1,3-thiazol-2-amine
CID 3164022
2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)guanidine;hydrochloride
CID 145961142
4,5,6,7,8,9,10,11,12,13-Decahydrocyclododeca[d][1,3]thiazol-2-amine
CID 950890
6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine
CID 346922
4,5,6,7-Tetrahydro-1,3-benzothiazol-2-amine--hydrogen chloride (1/1)
CID 2823910
4H,5H,6H,7H,8H-cyclohepta[d][1,3]thiazol-2-amine
CID 4362935
2,4-Dimethyl-5-pentylthiazole
CID 55295886
5-(2-Aminoethyl)-4-methyl-1,3-thiazol-2-amine;hydrobromide
CID 45261548

Frequently Asked Questions

What is the IUPAC name of 4-butyl-5-propyl-1,3-thiazol-2-amine?
The IUPAC name of 4-butyl-5-propyl-1,3-thiazol-2-amine (CID 23585837) is 4-butyl-5-propyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-butyl-5-propyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-butyl-5-propyl-1,3-thiazol-2-amine is CCCCc1nc(N)sc1CCC.
What is the InChIKey of 4-butyl-5-propyl-1,3-thiazol-2-amine?
The InChIKey is ZNFBTPMYWAYKSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2S/c1-3-5-7-8-9(6-4-2)13-10(11)12-8/h3-7H2,1-2H3,(H2,11,12).
What are the key properties of 4-butyl-5-propyl-1,3-thiazol-2-amine?
4-butyl-5-propyl-1,3-thiazol-2-amine has a molecular weight of 198.33 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-5-propyl-1,3-thiazol-2-amine is sourced from PubChem (CID 23585837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).