N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide

C12H18N4O3 — CID 43348702

IUPACN-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide
SMILESO=C(CN1CCNCC1)NC(=O)NCc1ccco1
InChIInChI=1S/C12H18N4O3/c17-11(9-16-5-3-13-4-6-16)15-12(18)14-8-10-2-1-7-19-10/h1-2,7,13H,3-6,8-9H2,(H2,14,15,17,18)
InChIKeyVBDFLFUSWKQNPM-UHFFFAOYSA-N
MW266.30 g/mol
LogP-0.49
Rot. Bonds4

About N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide

N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide (PubChem CID 43348702) has the molecular formula C12H18N4O3 and a molecular weight of 266.30 g/mol. Its IUPAC name is N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide
PubChem CID43348702
Molecular FormulaC12H18N4O3
Molecular Weight266.30 g/mol
Exact Mass266.14
IUPAC NameN-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide
SMILESO=C(CN1CCNCC1)NC(=O)NCc1ccco1
InChIInChI=1S/C12H18N4O3/c17-11(9-16-5-3-13-4-6-16)15-12(18)14-8-10-2-1-7-19-10/h1-2,7,13H,3-6,8-9H2,(H2,14,15,17,18)
InChIKeyVBDFLFUSWKQNPM-UHFFFAOYSA-N
XLogP-0.49
TPSA86.61 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 5-0.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1,4-diazepan-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 43162513
2-[4-(4-fluorobenzoyl)piperazin-1-yl]-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 36875873
2-[4-(2-fluorophenyl)piperazin-1-yl]-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 2697596
2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 8904767
2-(3-aminopiperidin-1-yl)-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 61295561
N-(2-piperazin-1-ylacetyl)furan-2-carboxamide
CID 43162394
2-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 35148049
2-(azetidin-3-ylmethylsulfanyl)-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 66289917
N-[4-(furan-2-yl)butan-2-yl]-2-piperazin-1-ylacetamide
CID 61249923
N-[3-(furan-2-ylmethoxy)propyl]-2-piperazin-1-ylacetamide
CID 61275324
2-[2-(4-chlorophenyl)morpholin-4-yl]-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 55827797
N-(furan-2-ylmethyl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide
CID 9102139

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide?
The IUPAC name of N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide (CID 43348702) is N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide?
The canonical SMILES for N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide is O=C(CN1CCNCC1)NC(=O)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide?
The InChIKey is VBDFLFUSWKQNPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O3/c17-11(9-16-5-3-13-4-6-16)15-12(18)14-8-10-2-1-7-19-10/h1-2,7,13H,3-6,8-9H2,(H2,14,15,17,18).
What are the key properties of N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide?
N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide has a molecular weight of 266.30 g/mol, XLogP of -0.49, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethylcarbamoyl)-2-piperazin-1-ylacetamide is sourced from PubChem (CID 43348702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).