5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine

C11H14N2S2 — CID 104599839

IUPAC5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine
SMILESCCCc1cnc(NCc2cccs2)s1
InChIInChI=1S/C11H14N2S2/c1-2-4-10-8-13-11(15-10)12-7-9-5-3-6-14-9/h3,5-6,8H,2,4,7H2,1H3,(H,12,13)
InChIKeySMLGLXMGAZRJJN-UHFFFAOYSA-N
MW238.38 g/mol
LogP3.77
Rot. Bonds5

About 5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine

5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine (PubChem CID 104599839) has the molecular formula C11H14N2S2 and a molecular weight of 238.38 g/mol. Its IUPAC name is 5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine
PubChem CID104599839
Molecular FormulaC11H14N2S2
Molecular Weight238.38 g/mol
Exact Mass238.06
IUPAC Name5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine
SMILESCCCc1cnc(NCc2cccs2)s1
InChIInChI=1S/C11H14N2S2/c1-2-4-10-8-13-11(15-10)12-7-9-5-3-6-14-9/h3,5-6,8H,2,4,7H2,1H3,(H,12,13)
InChIKeySMLGLXMGAZRJJN-UHFFFAOYSA-N
XLogP3.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.38
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-propyl-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine
CID 104599847
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-5-propyl-1,3-thiazol-2-amine
CID 104599843
5-butyl-N-(thiophen-2-ylmethyl)-1,3,4-thiadiazol-2-amine
CID 115910533
5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine
CID 136574616
N-[(1-ethylpyrazol-4-yl)methyl]-5-propyl-1,3-thiazol-2-amine
CID 75505668
N-propyl-5-(thiophen-2-ylsulfanylmethyl)-1,3-thiazol-2-amine
CID 79775172
6-N-ethyl-2-propyl-4-N-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine
CID 80955053
5-chloro-N-(thiophen-2-ylmethyl)pyrimidin-2-amine
CID 79557672
5-methyl-N-(thiophen-2-ylmethyl)-1,3-oxazol-2-amine
CID 130735490
N-benzyl-5-[[(4-thiophen-2-yl-1,3-thiazol-2-yl)amino]methyl]-1,3-thiazol-2-amine;dihydrochloride
CID 87535658
2-N-ethyl-5-methyl-4-N-(thiophen-2-ylmethyl)pyrimidine-2,4-diamine
CID 80775595
5-methyl-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 43173671

Frequently Asked Questions

What is the IUPAC name of 5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine (CID 104599839) is 5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine is CCCc1cnc(NCc2cccs2)s1.
What is the InChIKey of 5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine?
The InChIKey is SMLGLXMGAZRJJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2S2/c1-2-4-10-8-13-11(15-10)12-7-9-5-3-6-14-9/h3,5-6,8H,2,4,7H2,1H3,(H,12,13).
What are the key properties of 5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine?
5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine has a molecular weight of 238.38 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 104599839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).