N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide

C14H16N2O2S — CID 110383761

IUPACN-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
SMILESCc1nc(-c2ccc(C(=O)NC3CCCC3)o2)cs1
InChIInChI=1S/C14H16N2O2S/c1-9-15-11(8-19-9)12-6-7-13(18-12)14(17)16-10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,16,17)
InChIKeyCHSKQLAOEHTBSR-UHFFFAOYSA-N
MW276.36 g/mol
LogP3.38
Rot. Bonds3

About N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide

N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide (PubChem CID 110383761) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
PubChem CID110383761
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
SMILESCc1nc(-c2ccc(C(=O)NC3CCCC3)o2)cs1
InChIInChI=1S/C14H16N2O2S/c1-9-15-11(8-19-9)12-6-7-13(18-12)14(17)16-10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,16,17)
InChIKeyCHSKQLAOEHTBSR-UHFFFAOYSA-N
XLogP3.38
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide?
The IUPAC name of N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide (CID 110383761) is N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide?
The canonical SMILES for N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide is Cc1nc(-c2ccc(C(=O)NC3CCCC3)o2)cs1.
What is the InChIKey of N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide?
The InChIKey is CHSKQLAOEHTBSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-9-15-11(8-19-9)12-6-7-13(18-12)14(17)16-10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,16,17).
What are the key properties of N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide?
N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide has a molecular weight of 276.36 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide is sourced from PubChem (CID 110383761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).