N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide

C16H15N3O2S — CID 113026265

IUPACN-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)Nc1ccc(NCc2ccco2)cn1
InChIInChI=1S/C16H15N3O2S/c20-16(9-14-4-2-8-22-14)19-15-6-5-12(10-18-15)17-11-13-3-1-7-21-13/h1-8,10,17H,9,11H2,(H,18,19,20)
InChIKeyFZSMSBQHYTWEBS-UHFFFAOYSA-N
MW313.38 g/mol
LogP3.53
Rot. Bonds6

About N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide

N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide (PubChem CID 113026265) has the molecular formula C16H15N3O2S and a molecular weight of 313.38 g/mol. Its IUPAC name is N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide
PubChem CID113026265
Molecular FormulaC16H15N3O2S
Molecular Weight313.38 g/mol
Exact Mass313.09
IUPAC NameN-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)Nc1ccc(NCc2ccco2)cn1
InChIInChI=1S/C16H15N3O2S/c20-16(9-14-4-2-8-22-14)19-15-6-5-12(10-18-15)17-11-13-3-1-7-21-13/h1-8,10,17H,9,11H2,(H,18,19,20)
InChIKeyFZSMSBQHYTWEBS-UHFFFAOYSA-N
XLogP3.53
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(furan-2-ylmethylamino)phenyl]-2-thiophen-2-ylacetamide
CID 112981805
N-[5-(furan-2-ylmethylamino)-2-pyridinyl]thiophene-2-carboxamide
CID 113026241
N-[6-(methylamino)-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 115268484
N-[5-(furan-2-ylmethylamino)-2-pyridinyl]pentanamide
CID 113026234
N-[5-(3,5-dichloroanilino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113036797
N-[6-(4-fluoroanilino)-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 113018323
3-amino-N-[6-(furan-2-ylmethylamino)-3-pyridinyl]propanamide
CID 39179353
N-[6-(pentylamino)-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 113015222
2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide
CID 113032823
N-[6-(cyclohexylamino)-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 113010070
3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide
CID 113026285
N-[5-(1,3-benzodioxol-5-ylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113036157

Frequently Asked Questions

What is the IUPAC name of N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide (CID 113026265) is N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)Nc1ccc(NCc2ccco2)cn1.
What is the InChIKey of N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide?
The InChIKey is FZSMSBQHYTWEBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2S/c20-16(9-14-4-2-8-22-14)19-15-6-5-12(10-18-15)17-11-13-3-1-7-21-13/h1-8,10,17H,9,11H2,(H,18,19,20).
What are the key properties of N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide?
N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide has a molecular weight of 313.38 g/mol, XLogP of 3.53, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 113026265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).