4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide

C14H21N3O3 — CID 119103267

IUPAC4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(CNC(=O)c2ccoc2)CC1
InChIInChI=1S/C14H21N3O3/c1-16(2)14(19)17-6-3-11(4-7-17)9-15-13(18)12-5-8-20-10-12/h5,8,10-11H,3-4,6-7,9H2,1-2H3,(H,15,18)
InChIKeySDQLPADKVZOREG-UHFFFAOYSA-N
MW279.34 g/mol
LogP1.40
Rot. Bonds3

About 4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide

4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide (PubChem CID 119103267) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is 4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide
PubChem CID119103267
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC Name4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(CNC(=O)c2ccoc2)CC1
InChIInChI=1S/C14H21N3O3/c1-16(2)14(19)17-6-3-11(4-7-17)9-15-13(18)12-5-8-20-10-12/h5,8,10-11H,3-4,6-7,9H2,1-2H3,(H,15,18)
InChIKeySDQLPADKVZOREG-UHFFFAOYSA-N
XLogP1.40
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-N-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]benzamide
CID 90521806
N-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-4-yl]methyl]furan-3-carboxamide
CID 131900099
N-[(1-pyrimidin-2-ylpiperidin-4-yl)methyl]furan-3-carboxamide
CID 131921279
N-[[1-(4-methyl-3-oxo-1,4-benzoxazine-6-carbonyl)piperidin-4-yl]methyl]furan-3-carboxamide
CID 131908186
N-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]-4-nitrobenzamide
CID 90521763
N-[2-(cyclopentylmethylamino)-2-oxoethyl]furan-3-carboxamide
CID 38304482
1-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]-3-propylurea
CID 90522000
N-[[1-(2-oxo-1-oxaspiro[4.5]decane-4-carbonyl)piperidin-4-yl]methyl]furan-3-carboxamide
CID 131930942
N-[[1-(dimethylcarbamoyl)piperidin-4-yl]methyl]-N'-phenyloxamide
CID 121020500
N-[[1-(2-methylpropanoyl)piperidin-4-yl]methyl]-6-oxopyran-3-carboxamide
CID 164688722
N,N-dimethyl-4-[(3-phenylpropanoylamino)methyl]piperidine-1-carboxamide
CID 119103247
N-[[1-(6-fluoro-2-methylquinoline-4-carbonyl)piperidin-4-yl]methyl]furan-3-carboxamide
CID 131938558

Frequently Asked Questions

What is the IUPAC name of 4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide?
The IUPAC name of 4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide (CID 119103267) is 4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide?
The canonical SMILES for 4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide is CN(C)C(=O)N1CCC(CNC(=O)c2ccoc2)CC1.
What is the InChIKey of 4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide?
The InChIKey is SDQLPADKVZOREG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-16(2)14(19)17-6-3-11(4-7-17)9-15-13(18)12-5-8-20-10-12/h5,8,10-11H,3-4,6-7,9H2,1-2H3,(H,15,18).
What are the key properties of 4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide?
4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide has a molecular weight of 279.34 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide is sourced from PubChem (CID 119103267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).