N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide

C14H13N3O2S — CID 122244604

IUPACN-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide
SMILESO=C(NCCn1cc(-c2ccco2)cn1)c1ccsc1
InChIInChI=1S/C14H13N3O2S/c18-14(11-3-7-20-10-11)15-4-5-17-9-12(8-16-17)13-2-1-6-19-13/h1-3,6-10H,4-5H2,(H,15,18)
InChIKeyBSQWMPBXASIYRZ-UHFFFAOYSA-N
MW287.34 g/mol
LogP2.63
Rot. Bonds5

About N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide

N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide (PubChem CID 122244604) has the molecular formula C14H13N3O2S and a molecular weight of 287.34 g/mol. Its IUPAC name is N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide
PubChem CID122244604
Molecular FormulaC14H13N3O2S
Molecular Weight287.34 g/mol
Exact Mass287.07
IUPAC NameN-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide
SMILESO=C(NCCn1cc(-c2ccco2)cn1)c1ccsc1
InChIInChI=1S/C14H13N3O2S/c18-14(11-3-7-20-10-11)15-4-5-17-9-12(8-16-17)13-2-1-6-19-13/h1-3,6-10H,4-5H2,(H,15,18)
InChIKeyBSQWMPBXASIYRZ-UHFFFAOYSA-N
XLogP2.63
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide?
The IUPAC name of N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide (CID 122244604) is N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide.
What is the SMILES notation for N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide?
The canonical SMILES for N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide is O=C(NCCn1cc(-c2ccco2)cn1)c1ccsc1.
What is the InChIKey of N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide?
The InChIKey is BSQWMPBXASIYRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2S/c18-14(11-3-7-20-10-11)15-4-5-17-9-12(8-16-17)13-2-1-6-19-13/h1-3,6-10H,4-5H2,(H,15,18).
What are the key properties of N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide?
N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide has a molecular weight of 287.34 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(furan-2-yl)pyrazol-1-yl]ethyl]thiophene-3-carboxamide is sourced from PubChem (CID 122244604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).