N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide

C15H18N2O3S — CID 111538275

IUPACN-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide
SMILESO=C(CC1(O)CCCCC1)Nc1nc(-c2ccco2)cs1
InChIInChI=1S/C15H18N2O3S/c18-13(9-15(19)6-2-1-3-7-15)17-14-16-11(10-21-14)12-5-4-8-20-12/h4-5,8,10,19H,1-3,6-7,9H2,(H,16,17,18)
InChIKeyPTPVRHYJWHMWEH-UHFFFAOYSA-N
MW306.39 g/mol
LogP3.43
Rot. Bonds4

About N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide

N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide (PubChem CID 111538275) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide.

Molecular Properties

Compound NameN-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide
PubChem CID111538275
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC NameN-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide
SMILESO=C(CC1(O)CCCCC1)Nc1nc(-c2ccco2)cs1
InChIInChI=1S/C15H18N2O3S/c18-13(9-15(19)6-2-1-3-7-15)17-14-16-11(10-21-14)12-5-4-8-20-12/h4-5,8,10,19H,1-3,6-7,9H2,(H,16,17,18)
InChIKeyPTPVRHYJWHMWEH-UHFFFAOYSA-N
XLogP3.43
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide?
The IUPAC name of N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide (CID 111538275) is N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide.
What is the SMILES notation for N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide?
The canonical SMILES for N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide is O=C(CC1(O)CCCCC1)Nc1nc(-c2ccco2)cs1.
What is the InChIKey of N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide?
The InChIKey is PTPVRHYJWHMWEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S/c18-13(9-15(19)6-2-1-3-7-15)17-14-16-11(10-21-14)12-5-4-8-20-12/h4-5,8,10,19H,1-3,6-7,9H2,(H,16,17,18).
What are the key properties of N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide?
N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide has a molecular weight of 306.39 g/mol, XLogP of 3.43, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-(1-hydroxycyclohexyl)acetamide is sourced from PubChem (CID 111538275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).