2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine

C14H20N2OS — CID 90705322

IUPAC2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine
SMILESCCc1ccc(C2=CC(N)ON2C2CCCC2)s1
InChIInChI=1S/C14H20N2OS/c1-2-11-7-8-13(18-11)12-9-14(15)17-16(12)10-5-3-4-6-10/h7-10,14H,2-6,15H2,1H3
InChIKeyARCJANHAELSDKM-UHFFFAOYSA-N
MW264.39 g/mol
LogP3.13
Rot. Bonds3

About 2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine

2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine (PubChem CID 90705322) has the molecular formula C14H20N2OS and a molecular weight of 264.39 g/mol. Its IUPAC name is 2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine.

Molecular Properties

Compound Name2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine
PubChem CID90705322
Molecular FormulaC14H20N2OS
Molecular Weight264.39 g/mol
Exact Mass264.13
IUPAC Name2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine
SMILESCCc1ccc(C2=CC(N)ON2C2CCCC2)s1
InChIInChI=1S/C14H20N2OS/c1-2-11-7-8-13(18-11)12-9-14(15)17-16(12)10-5-3-4-6-10/h7-10,14H,2-6,15H2,1H3
InChIKeyARCJANHAELSDKM-UHFFFAOYSA-N
XLogP3.13
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine?
The IUPAC name of 2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine (CID 90705322) is 2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine.
What is the SMILES notation for 2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine?
The canonical SMILES for 2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine is CCc1ccc(C2=CC(N)ON2C2CCCC2)s1.
What is the InChIKey of 2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine?
The InChIKey is ARCJANHAELSDKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2OS/c1-2-11-7-8-13(18-11)12-9-14(15)17-16(12)10-5-3-4-6-10/h7-10,14H,2-6,15H2,1H3.
What are the key properties of 2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine?
2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine has a molecular weight of 264.39 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-3-(5-ethylthiophen-2-yl)-5H-1,2-oxazol-5-amine is sourced from PubChem (CID 90705322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).