4-[(2R)-piperidin-2-yl]furan-3-carbonitrile

C10H12N2O — CID 130782183

IUPAC4-[(2R)-piperidin-2-yl]furan-3-carbonitrile
SMILESN#Cc1cocc1[C@H]1CCCCN1
InChIInChI=1S/C10H12N2O/c11-5-8-6-13-7-9(8)10-3-1-2-4-12-10/h6-7,10,12H,1-4H2/t10-/m1/s1
InChIKeyRFETVPJEFAUVRL-SNVBAGLBSA-N
MW176.22 g/mol
LogP1.97
Rot. Bonds1

About 4-[(2R)-piperidin-2-yl]furan-3-carbonitrile

4-[(2R)-piperidin-2-yl]furan-3-carbonitrile (PubChem CID 130782183) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 4-[(2R)-piperidin-2-yl]furan-3-carbonitrile.

Molecular Properties

Compound Name4-[(2R)-piperidin-2-yl]furan-3-carbonitrile
PubChem CID130782183
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name4-[(2R)-piperidin-2-yl]furan-3-carbonitrile
SMILESN#Cc1cocc1[C@H]1CCCCN1
InChIInChI=1S/C10H12N2O/c11-5-8-6-13-7-9(8)10-3-1-2-4-12-10/h6-7,10,12H,1-4H2/t10-/m1/s1
InChIKeyRFETVPJEFAUVRL-SNVBAGLBSA-N
XLogP1.97
TPSA48.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2S)-pyrrolidin-2-yl]furan-3-carbonitrile
CID 131097005
2,4-difluoro-5-piperidin-2-ylbenzonitrile
CID 117317640
2-hydroxy-3-[(2S)-piperidin-2-yl]benzonitrile
CID 131554616
4-[(2S)-piperidin-2-yl]pyridine-3-carbonitrile
CID 55263705
(2S)-2-(4-methylfuran-3-yl)pyrrolidine
CID 96733805
2-chloro-3-pyrrolidin-2-ylbenzonitrile
CID 130043692
2-(azepan-2-yl)-4-(trifluoromethyl)benzonitrile
CID 141175039
4-pyrrolidin-2-ylpyridine-3-carbonitrile
CID 82411637
5-hydroxy-2-[(2S)-pyrrolidin-2-yl]benzonitrile
CID 130632788
2-bromo-3-[(2S)-pyrrolidin-2-yl]benzonitrile
CID 130644804
5-[(2S)-pyrrolidin-2-yl]furan-2-carbonitrile
CID 131142987
3-bromo-4-hydroxy-5-[(2S)-piperidin-2-yl]benzonitrile
CID 131346638

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-piperidin-2-yl]furan-3-carbonitrile?
The IUPAC name of 4-[(2R)-piperidin-2-yl]furan-3-carbonitrile (CID 130782183) is 4-[(2R)-piperidin-2-yl]furan-3-carbonitrile.
What is the SMILES notation for 4-[(2R)-piperidin-2-yl]furan-3-carbonitrile?
The canonical SMILES for 4-[(2R)-piperidin-2-yl]furan-3-carbonitrile is N#Cc1cocc1[C@H]1CCCCN1.
What is the InChIKey of 4-[(2R)-piperidin-2-yl]furan-3-carbonitrile?
The InChIKey is RFETVPJEFAUVRL-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H12N2O/c11-5-8-6-13-7-9(8)10-3-1-2-4-12-10/h6-7,10,12H,1-4H2/t10-/m1/s1.
What are the key properties of 4-[(2R)-piperidin-2-yl]furan-3-carbonitrile?
4-[(2R)-piperidin-2-yl]furan-3-carbonitrile has a molecular weight of 176.22 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-piperidin-2-yl]furan-3-carbonitrile is sourced from PubChem (CID 130782183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).