N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide

C14H18N2O2S — CID 47014181

IUPACN-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
SMILESCC1CC1c1ccc(CCC(=O)NC2=NCCS2)o1
InChIInChI=1S/C14H18N2O2S/c1-9-8-11(9)12-4-2-10(18-12)3-5-13(17)16-14-15-6-7-19-14/h2,4,9,11H,3,5-8H2,1H3,(H,15,16,17)
InChIKeyBFJCRLULJXQFLD-UHFFFAOYSA-N
MW278.38 g/mol
LogP2.55
Rot. Bonds4

About N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide

N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide (PubChem CID 47014181) has the molecular formula C14H18N2O2S and a molecular weight of 278.38 g/mol. Its IUPAC name is N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide.

Molecular Properties

Compound NameN-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
PubChem CID47014181
Molecular FormulaC14H18N2O2S
Molecular Weight278.38 g/mol
Exact Mass278.11
IUPAC NameN-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
SMILESCC1CC1c1ccc(CCC(=O)NC2=NCCS2)o1
InChIInChI=1S/C14H18N2O2S/c1-9-8-11(9)12-4-2-10(18-12)3-5-13(17)16-14-15-6-7-19-14/h2,4,9,11H,3,5-8H2,1H3,(H,15,16,17)
InChIKeyBFJCRLULJXQFLD-UHFFFAOYSA-N
XLogP2.55
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide?
The IUPAC name of N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide (CID 47014181) is N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide.
What is the SMILES notation for N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide?
The canonical SMILES for N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide is CC1CC1c1ccc(CCC(=O)NC2=NCCS2)o1.
What is the InChIKey of N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide?
The InChIKey is BFJCRLULJXQFLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S/c1-9-8-11(9)12-4-2-10(18-12)3-5-13(17)16-14-15-6-7-19-14/h2,4,9,11H,3,5-8H2,1H3,(H,15,16,17).
What are the key properties of N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide?
N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide has a molecular weight of 278.38 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dihydro-1,3-thiazol-2-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide is sourced from PubChem (CID 47014181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).