5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide

C19H25N3O2 — CID 42850852

IUPAC5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
SMILESCC1CCN(Cc2ccc(C(=O)NCCc3ccccn3)o2)CC1
InChIInChI=1S/C19H25N3O2/c1-15-8-12-22(13-9-15)14-17-5-6-18(24-17)19(23)21-11-7-16-4-2-3-10-20-16/h2-6,10,15H,7-9,11-14H2,1H3,(H,21,23)
InChIKeyPZMCAAANHTZLCH-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.88
Rot. Bonds6

About 5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide

5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide (PubChem CID 42850852) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
PubChem CID42850852
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
SMILESCC1CCN(Cc2ccc(C(=O)NCCc3ccccn3)o2)CC1
InChIInChI=1S/C19H25N3O2/c1-15-8-12-22(13-9-15)14-17-5-6-18(24-17)19(23)21-11-7-16-4-2-3-10-20-16/h2-6,10,15H,7-9,11-14H2,1H3,(H,21,23)
InChIKeyPZMCAAANHTZLCH-UHFFFAOYSA-N
XLogP2.88
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
CID 32623665
5-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-N-(pyridin-2-ylmethyl)furan-2-carboxamide
CID 46055568
5-[[2-[[cyclopropanecarbonyl(propyl)amino]methyl]pyrrol-1-yl]methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
CID 42666179
5-[[4-(4-benzylpiperazin-1-yl)-6-methylpyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
CID 42825115
5-[(4-benzylpiperidin-1-yl)methyl]-N-propylfuran-2-carboxamide
CID 42850909
2-[(4-benzylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)-1,3-oxazole-4-carboxamide
CID 42850919
3-(4-methylpiperidin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide
CID 97407087
5-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-N-(pyridin-2-ylmethyl)furan-2-carboxamide
CID 42850938
5-(methylsulfamoyl)-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
CID 39898259
5-[[4-(4-benzylpiperazin-1-yl)-6-phenylpyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
CID 42825016
5-[(4-methylpiperidin-1-yl)methyl]-N-[1-(2-pyrazol-1-ylphenyl)ethyl]furan-2-carboxamide
CID 131951497
N-[1-(1,3-benzothiazol-2-yl)ethyl]-5-[(4-methylpiperidin-1-yl)methyl]furan-2-carboxamide
CID 46956995

Frequently Asked Questions

What is the IUPAC name of 5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
The IUPAC name of 5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide (CID 42850852) is 5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide.
What is the SMILES notation for 5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
The canonical SMILES for 5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide is CC1CCN(Cc2ccc(C(=O)NCCc3ccccn3)o2)CC1.
What is the InChIKey of 5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
The InChIKey is PZMCAAANHTZLCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-15-8-12-22(13-9-15)14-17-5-6-18(24-17)19(23)21-11-7-16-4-2-3-10-20-16/h2-6,10,15H,7-9,11-14H2,1H3,(H,21,23).
What are the key properties of 5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-methylpiperidin-1-yl)methyl]-N-(2-pyridin-2-ylethyl)furan-2-carboxamide is sourced from PubChem (CID 42850852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).