1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide

C12H14N2O2 — CID 78994732

IUPAC1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide
SMILESN#CC1(C(=O)NCCc2ccco2)CCC1
InChIInChI=1S/C12H14N2O2/c13-9-12(5-2-6-12)11(15)14-7-4-10-3-1-8-16-10/h1,3,8H,2,4-7H2,(H,14,15)
InChIKeyJHZPVRBSISPRPK-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.63
Rot. Bonds4

About 1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide

1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide (PubChem CID 78994732) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide
PubChem CID78994732
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide
SMILESN#CC1(C(=O)NCCc2ccco2)CCC1
InChIInChI=1S/C12H14N2O2/c13-9-12(5-2-6-12)11(15)14-7-4-10-3-1-8-16-10/h1,3,8H,2,4-7H2,(H,14,15)
InChIKeyJHZPVRBSISPRPK-UHFFFAOYSA-N
XLogP1.63
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyano-N-[4-(furan-2-yl)butan-2-yl]cyclopentane-1-carboxamide
CID 60717527
N-[2-(1-benzofuran-3-yl)ethyl]-1-cyanocyclobutane-1-carboxamide
CID 115183377
1-cyano-N-[1-(furan-2-yl)propan-2-yl]cyclohexane-1-carboxamide
CID 61461953
1-cyano-N-(2-pyridin-3-ylethyl)cyclobutane-1-carboxamide
CID 78995084
1-cyano-N-[2-(furan-2-yl)-2-hydroxyethyl]cyclohexane-1-carboxamide
CID 110904465
N-[2-(furan-2-yl)ethyl]-1-(N'-hydroxycarbamimidoyl)cyclohexane-1-carboxamide
CID 76921509
1-cyano-N-[2-(cyclohexen-1-yl)ethyl]cyclobutane-1-carboxamide
CID 78994819
N-[4-[[(1-cyanocyclopentanecarbonyl)amino]methyl]phenyl]furan-2-carboxamide
CID 39856169
1-cyano-N-[2-(2,5-difluorophenyl)ethyl]cyclobutane-1-carboxamide
CID 115183365
1-cyano-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]cyclohexane-1-carboxamide
CID 113253187
3-ethyl-N-[2-(furan-2-yl)ethyl]piperidine-3-carboxamide
CID 63130359
1-(4-tert-butylphenyl)-N-[2-(furan-2-yl)ethyl]cyclopropane-1-carboxamide
CID 55606445

Frequently Asked Questions

What is the IUPAC name of 1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide?
The IUPAC name of 1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide (CID 78994732) is 1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide?
The canonical SMILES for 1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide is N#CC1(C(=O)NCCc2ccco2)CCC1.
What is the InChIKey of 1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide?
The InChIKey is JHZPVRBSISPRPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c13-9-12(5-2-6-12)11(15)14-7-4-10-3-1-8-16-10/h1,3,8H,2,4-7H2,(H,14,15).
What are the key properties of 1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide?
1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide has a molecular weight of 218.26 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyano-N-[2-(furan-2-yl)ethyl]cyclobutane-1-carboxamide is sourced from PubChem (CID 78994732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).