N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide

C18H23N5O2 — CID 95310269

IUPACN-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide
SMILESCc1oc(NC(=O)CN2CCCC[C@@H]2Cn2cccn2)c(C#N)c1C
InChIInChI=1S/C18H23N5O2/c1-13-14(2)25-18(16(13)10-19)21-17(24)12-22-8-4-3-6-15(22)11-23-9-5-7-20-23/h5,7,9,15H,3-4,6,8,11-12H2,1-2H3,(H,21,24)/t15-/m1/s1
InChIKeyKGMZOAWEBYEODF-OAHLLOKOSA-N
MW341.42 g/mol
LogP2.46
Rot. Bonds5

About N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide

N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide (PubChem CID 95310269) has the molecular formula C18H23N5O2 and a molecular weight of 341.42 g/mol. Its IUPAC name is N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide
PubChem CID95310269
Molecular FormulaC18H23N5O2
Molecular Weight341.42 g/mol
Exact Mass341.19
IUPAC NameN-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide
SMILESCc1oc(NC(=O)CN2CCCC[C@@H]2Cn2cccn2)c(C#N)c1C
InChIInChI=1S/C18H23N5O2/c1-13-14(2)25-18(16(13)10-19)21-17(24)12-22-8-4-3-6-15(22)11-23-9-5-7-20-23/h5,7,9,15H,3-4,6,8,11-12H2,1-2H3,(H,21,24)/t15-/m1/s1
InChIKeyKGMZOAWEBYEODF-OAHLLOKOSA-N
XLogP2.46
TPSA87.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-cyanocyclopentyl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide
CID 95352596
N-(5-methyl-1,2-oxazol-3-yl)-3-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]propanamide
CID 95609321
N-(5-chloro-2-pyridinyl)-2-[2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]acetamide
CID 56780407
N-(3-cyano-4,5-dimethylfuran-2-yl)-2-(4-hydroxy-3-methylpiperidin-1-yl)acetamide
CID 114681461
N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[4-[methyl(pyridazin-3-yl)amino]piperidin-1-yl]acetamide
CID 71878529
(2S)-1-(2-methylprop-2-enyl)-2-(pyrazol-1-ylmethyl)piperidine
CID 95325556
2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95609233
N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]acetamide
CID 86915581
2-[(2S)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetonitrile
CID 95609183
N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-[2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]acetamide
CID 46981076
2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(3-cyano-4,5-dimethylfuran-2-yl)acetamide
CID 46402825
N,N,4-trimethyl-2-[[2-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]acetyl]amino]-1,3-thiazole-5-carboxamide
CID 92612705

Frequently Asked Questions

What is the IUPAC name of N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide (CID 95310269) is N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide is Cc1oc(NC(=O)CN2CCCC[C@@H]2Cn2cccn2)c(C#N)c1C.
What is the InChIKey of N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide?
The InChIKey is KGMZOAWEBYEODF-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H23N5O2/c1-13-14(2)25-18(16(13)10-19)21-17(24)12-22-8-4-3-6-15(22)11-23-9-5-7-20-23/h5,7,9,15H,3-4,6,8,11-12H2,1-2H3,(H,21,24)/t15-/m1/s1.
What are the key properties of N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide?
N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide has a molecular weight of 341.42 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 95310269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).