5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide

C13H14ClN3O2 — CID 103617988

IUPAC5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide
SMILESO=C(NC1CCCC1n1ccnc1)c1ccc(Cl)o1
InChIInChI=1S/C13H14ClN3O2/c14-12-5-4-11(19-12)13(18)16-9-2-1-3-10(9)17-7-6-15-8-17/h4-10H,1-3H2,(H,16,18)
InChIKeyWXBWMTGTHHWMPZ-UHFFFAOYSA-N
MW279.73 g/mol
LogP2.65
Rot. Bonds3

About 5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide

5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide (PubChem CID 103617988) has the molecular formula C13H14ClN3O2 and a molecular weight of 279.73 g/mol. Its IUPAC name is 5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide
PubChem CID103617988
Molecular FormulaC13H14ClN3O2
Molecular Weight279.73 g/mol
Exact Mass279.08
IUPAC Name5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide
SMILESO=C(NC1CCCC1n1ccnc1)c1ccc(Cl)o1
InChIInChI=1S/C13H14ClN3O2/c14-12-5-4-11(19-12)13(18)16-9-2-1-3-10(9)17-7-6-15-8-17/h4-10H,1-3H2,(H,16,18)
InChIKeyWXBWMTGTHHWMPZ-UHFFFAOYSA-N
XLogP2.65
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.73
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide?
The IUPAC name of 5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide (CID 103617988) is 5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide?
The canonical SMILES for 5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide is O=C(NC1CCCC1n1ccnc1)c1ccc(Cl)o1.
What is the InChIKey of 5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide?
The InChIKey is WXBWMTGTHHWMPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN3O2/c14-12-5-4-11(19-12)13(18)16-9-2-1-3-10(9)17-7-6-15-8-17/h4-10H,1-3H2,(H,16,18).
What are the key properties of 5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide?
5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide has a molecular weight of 279.73 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide is sourced from PubChem (CID 103617988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).