N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide

C12H14N2O2 — CID 62961798

IUPACN-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)NC2CCCC2C#N)o1
InChIInChI=1S/C12H14N2O2/c1-8-5-6-11(16-8)12(15)14-10-4-2-3-9(10)7-13/h5-6,9-10H,2-4H2,1H3,(H,14,15)
InChIKeyMRXOREWAVLYEHA-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.01
Rot. Bonds2

About N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide

N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide (PubChem CID 62961798) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide
PubChem CID62961798
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC NameN-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)NC2CCCC2C#N)o1
InChIInChI=1S/C12H14N2O2/c1-8-5-6-11(16-8)12(15)14-10-4-2-3-9(10)7-13/h5-6,9-10H,2-4H2,1H3,(H,14,15)
InChIKeyMRXOREWAVLYEHA-UHFFFAOYSA-N
XLogP2.01
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R,2S,3S)-2,3-dimethylcyclohexyl]-5-methylfuran-2-carboxamide
CID 51969450
N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide
CID 103759065
N-(2-cyanocyclopentyl)-3-methyl-1,2-oxazole-5-carboxamide
CID 62961249
N-[(1S,2R)-2-tert-butylcyclohexyl]-5-methylfuran-2-carboxamide
CID 27459810
N-(2-carbamothioylcyclopentyl)-5-methylfuran-2-carboxamide
CID 62956749
N-(2-cyanocyclopentyl)-4-methyl-1,3-oxazole-5-carboxamide
CID 79605102
N-(2-cyanocyclopentyl)-3-methylthiophene-2-carboxamide
CID 62963070
N-(2-cyanocyclopentyl)-4-hydroxy-3-methylbenzamide
CID 113358590
N-(2-cyanocyclopentyl)-3-hydroxy-4-methylbenzamide
CID 62962345
N-(2-cyanocyclopentyl)-2,6-dimethoxybenzamide
CID 62960890
4-bromo-N-(2-cyanocyclopentyl)-3-methylbenzamide
CID 113339251
N-[(1R,2R)-2-cyanocyclohexyl]benzamide
CID 10656966

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide?
The IUPAC name of N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide (CID 62961798) is N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide.
What is the SMILES notation for N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide?
The canonical SMILES for N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide is Cc1ccc(C(=O)NC2CCCC2C#N)o1.
What is the InChIKey of N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide?
The InChIKey is MRXOREWAVLYEHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-8-5-6-11(16-8)12(15)14-10-4-2-3-9(10)7-13/h5-6,9-10H,2-4H2,1H3,(H,14,15).
What are the key properties of N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide?
N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide has a molecular weight of 218.26 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide is sourced from PubChem (CID 62961798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).