N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide

C15H24N2O2 — CID 114423858

IUPACN-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide
SMILESCc1cc(C(C)NC(=O)C2CC(C)CCN2)c(C)o1
InChIInChI=1S/C15H24N2O2/c1-9-5-6-16-14(7-9)15(18)17-11(3)13-8-10(2)19-12(13)4/h8-9,11,14,16H,5-7H2,1-4H3,(H,17,18)
InChIKeyQFYCYXMDLATDAP-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.46
Rot. Bonds3

About N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide

N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide (PubChem CID 114423858) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide
PubChem CID114423858
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide
SMILESCc1cc(C(C)NC(=O)C2CC(C)CCN2)c(C)o1
InChIInChI=1S/C15H24N2O2/c1-9-5-6-16-14(7-9)15(18)17-11(3)13-8-10(2)19-12(13)4/h8-9,11,14,16H,5-7H2,1-4H3,(H,17,18)
InChIKeyQFYCYXMDLATDAP-UHFFFAOYSA-N
XLogP2.46
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2,5-dimethylfuran-3-yl)ethyl]-3-methylpyrrolidine-2-carboxamide
CID 102779269
N-[1-(1-benzofuran-2-yl)ethyl]-4-methylpiperidine-2-carboxamide
CID 114423092
2-amino-N-[1-(2,5-dimethylfuran-3-yl)ethyl]cyclopropane-1-carboxamide
CID 114995788
N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpiperidine-2-carboxamide
CID 104921807
N-[1-(3-chlorophenyl)ethyl]-4-methylpiperidine-2-carboxamide
CID 114423587
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-3,5-dimethylpiperidine-1-carboxamide
CID 60597945
N-(1-cyclopropylethyl)-4-methylpiperidine-2-carboxamide
CID 114422825
3-[1-(2,5-dimethylfuran-3-yl)ethylcarbamoylamino]cyclopentane-1-carboxylic acid
CID 66030647
4-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidine-2-carboxamide
CID 114423857
3-methyl-2-[(4-methylpiperidine-2-carbonyl)amino]butanoic acid
CID 115866989
N-[1-[1-(2,5-dimethylfuran-3-yl)ethylamino]-3-hydroxy-1-oxobutan-2-yl]cyclopropanecarboxamide
CID 110014343
2-[1-(2,5-dimethylfuran-3-yl)ethylamino]-1-(3-methylpiperidin-1-yl)ethanone
CID 86789730

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide?
The IUPAC name of N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide (CID 114423858) is N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide?
The canonical SMILES for N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide is Cc1cc(C(C)NC(=O)C2CC(C)CCN2)c(C)o1.
What is the InChIKey of N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide?
The InChIKey is QFYCYXMDLATDAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-9-5-6-16-14(7-9)15(18)17-11(3)13-8-10(2)19-12(13)4/h8-9,11,14,16H,5-7H2,1-4H3,(H,17,18).
What are the key properties of N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide?
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-methylpiperidine-2-carboxamide is sourced from PubChem (CID 114423858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).