5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine

C15H20N2OS — CID 62064336

IUPAC5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine
SMILESCCCc1nc(N)sc1Cc1ccccc1COC
InChIInChI=1S/C15H20N2OS/c1-3-6-13-14(19-15(16)17-13)9-11-7-4-5-8-12(11)10-18-2/h4-5,7-8H,3,6,9-10H2,1-2H3,(H2,16,17)
InChIKeyGLRMPDZPHNZCPN-UHFFFAOYSA-N
MW276.40 g/mol
LogP3.41
Rot. Bonds6

About 5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine

5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine (PubChem CID 62064336) has the molecular formula C15H20N2OS and a molecular weight of 276.40 g/mol. Its IUPAC name is 5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine
PubChem CID62064336
Molecular FormulaC15H20N2OS
Molecular Weight276.40 g/mol
Exact Mass276.13
IUPAC Name5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine
SMILESCCCc1nc(N)sc1Cc1ccccc1COC
InChIInChI=1S/C15H20N2OS/c1-3-6-13-14(19-15(16)17-13)9-11-7-4-5-8-12(11)10-18-2/h4-5,7-8H,3,6,9-10H2,1-2H3,(H2,16,17)
InChIKeyGLRMPDZPHNZCPN-UHFFFAOYSA-N
XLogP3.41
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine?
The IUPAC name of 5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine (CID 62064336) is 5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine is CCCc1nc(N)sc1Cc1ccccc1COC.
What is the InChIKey of 5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine?
The InChIKey is GLRMPDZPHNZCPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2OS/c1-3-6-13-14(19-15(16)17-13)9-11-7-4-5-8-12(11)10-18-2/h4-5,7-8H,3,6,9-10H2,1-2H3,(H2,16,17).
What are the key properties of 5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine?
5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine has a molecular weight of 276.40 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[2-(methoxymethyl)phenyl]methyl]-4-propyl-1,3-thiazol-2-amine is sourced from PubChem (CID 62064336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).