N-(2-piperazin-1-ylacetyl)furan-2-carboxamide

C11H15N3O3 — CID 43162394

IUPACN-(2-piperazin-1-ylacetyl)furan-2-carboxamide
SMILESO=C(CN1CCNCC1)NC(=O)c1ccco1
InChIInChI=1S/C11H15N3O3/c15-10(8-14-5-3-12-4-6-14)13-11(16)9-2-1-7-17-9/h1-2,7,12H,3-6,8H2,(H,13,15,16)
InChIKeyYVQDBXUFQQLLEV-UHFFFAOYSA-N
MW237.26 g/mol
LogP-0.56
Rot. Bonds3

About N-(2-piperazin-1-ylacetyl)furan-2-carboxamide

N-(2-piperazin-1-ylacetyl)furan-2-carboxamide (PubChem CID 43162394) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is N-(2-piperazin-1-ylacetyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-piperazin-1-ylacetyl)furan-2-carboxamide
PubChem CID43162394
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC NameN-(2-piperazin-1-ylacetyl)furan-2-carboxamide
SMILESO=C(CN1CCNCC1)NC(=O)c1ccco1
InChIInChI=1S/C11H15N3O3/c15-10(8-14-5-3-12-4-6-14)13-11(16)9-2-1-7-17-9/h1-2,7,12H,3-6,8H2,(H,13,15,16)
InChIKeyYVQDBXUFQQLLEV-UHFFFAOYSA-N
XLogP-0.56
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-0.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(3-piperazin-1-ylazetidin-1-yl)acetyl]furan-2-carboxamide
CID 66196197
N-[2-(4-aminopiperidin-1-yl)acetyl]furan-2-carboxamide
CID 43556804
N-[2-(3,5-dimethylpiperazin-1-yl)acetyl]furan-2-carboxamide
CID 63872942
N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide
CID 43348702
N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide
CID 43162415
N-[3-oxo-3-(3-piperazin-1-ylpropylamino)propyl]furan-2-carboxamide
CID 119391210
methyl (3S)-1-[2-(furan-2-carbonylamino)-2-oxoethyl]piperidine-3-carboxylate
CID 115537539
N-[3-oxo-3-(3-piperazin-1-ylpropylamino)propyl]furan-2-carboxamide;hydrochloride
CID 119391209
N-[2-(2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridin-1-yl)acetyl]furan-2-carboxamide
CID 102681654
2-(1,4-diazepan-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 43162513
methyl 2-(furan-2-carbonylamino)-3-piperazin-1-ylpropanoate
CID 126615777
N-[2-[2-(hydroxymethyl)azepan-1-yl]acetyl]furan-2-carboxamide
CID 116637783

Frequently Asked Questions

What is the IUPAC name of N-(2-piperazin-1-ylacetyl)furan-2-carboxamide?
The IUPAC name of N-(2-piperazin-1-ylacetyl)furan-2-carboxamide (CID 43162394) is N-(2-piperazin-1-ylacetyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-piperazin-1-ylacetyl)furan-2-carboxamide?
The canonical SMILES for N-(2-piperazin-1-ylacetyl)furan-2-carboxamide is O=C(CN1CCNCC1)NC(=O)c1ccco1.
What is the InChIKey of N-(2-piperazin-1-ylacetyl)furan-2-carboxamide?
The InChIKey is YVQDBXUFQQLLEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c15-10(8-14-5-3-12-4-6-14)13-11(16)9-2-1-7-17-9/h1-2,7,12H,3-6,8H2,(H,13,15,16).
What are the key properties of N-(2-piperazin-1-ylacetyl)furan-2-carboxamide?
N-(2-piperazin-1-ylacetyl)furan-2-carboxamide has a molecular weight of 237.26 g/mol, XLogP of -0.56, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperazin-1-ylacetyl)furan-2-carboxamide is sourced from PubChem (CID 43162394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).