N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide

C16H24N2O3S — CID 91840943

IUPACN-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide
SMILESO=C(COCC1CCCCO1)NCCc1nc2c(s1)CCC2
InChIInChI=1S/C16H24N2O3S/c19-15(11-20-10-12-4-1-2-9-21-12)17-8-7-16-18-13-5-3-6-14(13)22-16/h12H,1-11H2,(H,17,19)
InChIKeySFCLXOUMLFZJFM-UHFFFAOYSA-N
MW324.45 g/mol
LogP1.88
Rot. Bonds7

About N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide

N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide (PubChem CID 91840943) has the molecular formula C16H24N2O3S and a molecular weight of 324.45 g/mol. Its IUPAC name is N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide.

Molecular Properties

Compound NameN-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide
PubChem CID91840943
Molecular FormulaC16H24N2O3S
Molecular Weight324.45 g/mol
Exact Mass324.15
IUPAC NameN-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide
SMILESO=C(COCC1CCCCO1)NCCc1nc2c(s1)CCC2
InChIInChI=1S/C16H24N2O3S/c19-15(11-20-10-12-4-1-2-9-21-12)17-8-7-16-18-13-5-3-6-14(13)22-16/h12H,1-11H2,(H,17,19)
InChIKeySFCLXOUMLFZJFM-UHFFFAOYSA-N
XLogP1.88
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide?
The IUPAC name of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide (CID 91840943) is N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide.
What is the SMILES notation for N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide?
The canonical SMILES for N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide is O=C(COCC1CCCCO1)NCCc1nc2c(s1)CCC2.
What is the InChIKey of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide?
The InChIKey is SFCLXOUMLFZJFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3S/c19-15(11-20-10-12-4-1-2-9-21-12)17-8-7-16-18-13-5-3-6-14(13)22-16/h12H,1-11H2,(H,17,19).
What are the key properties of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide?
N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide has a molecular weight of 324.45 g/mol, XLogP of 1.88, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-(oxan-2-ylmethoxy)acetamide is sourced from PubChem (CID 91840943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).