N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide

C18H19N3O2 — CID 19416050

IUPACN-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc(CN2CCCCC2)o1
InChIInChI=1S/C18H19N3O2/c19-12-14-6-2-3-7-16(14)20-18(22)17-9-8-15(23-17)13-21-10-4-1-5-11-21/h2-3,6-9H,1,4-5,10-11,13H2,(H,20,22)
InChIKeyPDPMUPRXVPVKRF-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.39
Rot. Bonds4

About N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide

N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide (PubChem CID 19416050) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
PubChem CID19416050
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc(CN2CCCCC2)o1
InChIInChI=1S/C18H19N3O2/c19-12-14-6-2-3-7-16(14)20-18(22)17-9-8-15(23-17)13-21-10-4-1-5-11-21/h2-3,6-9H,1,4-5,10-11,13H2,(H,20,22)
InChIKeyPDPMUPRXVPVKRF-UHFFFAOYSA-N
XLogP3.39
TPSA69.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide 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-(2-bromophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
CID 35332804
N-(3-chloro-2-methylphenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
CID 19415881
N-(2,6-dichlorophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
CID 19415907
N-(2-methyl-4-nitrophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
CID 19415957
N-(4-bromo-2-fluorophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
CID 19415916
N-ethyl-5-(piperidin-1-ylmethyl)furan-2-carboxamide
CID 19416150
N-(3-acetylphenyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide
CID 35336962
N-(2-cyanophenyl)-5-[(4-iodophenoxy)methyl]furan-2-carboxamide
CID 19440079
5-[[4-chloro-3,5-bis(difluoromethyl)pyrazol-1-yl]methyl]-N-(2-cyanophenyl)furan-2-carboxamide
CID 19413858
5-cyano-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide
CID 11231718
N-(2-cyanophenyl)-2-(4-piperidin-1-ylphenyl)acetamide
CID 110651282
5-(2-chlorophenyl)-N-(2-cyanophenyl)furan-2-carboxamide
CID 944882

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide (CID 19416050) is N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide is N#Cc1ccccc1NC(=O)c1ccc(CN2CCCCC2)o1.
What is the InChIKey of N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide?
The InChIKey is PDPMUPRXVPVKRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c19-12-14-6-2-3-7-16(14)20-18(22)17-9-8-15(23-17)13-21-10-4-1-5-11-21/h2-3,6-9H,1,4-5,10-11,13H2,(H,20,22).
What are the key properties of N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide?
N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide is sourced from PubChem (CID 19416050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).