5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide

C14H22N2O2 — CID 113400454

IUPAC5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide
SMILESCCc1ccc(C(=O)NCC2(C)CCCNC2)o1
InChIInChI=1S/C14H22N2O2/c1-3-11-5-6-12(18-11)13(17)16-10-14(2)7-4-8-15-9-14/h5-6,15H,3-4,7-10H2,1-2H3,(H,16,17)
InChIKeyQIKHYRMGAZNZBK-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.96
Rot. Bonds4

About 5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide

5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide (PubChem CID 113400454) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide
PubChem CID113400454
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide
SMILESCCc1ccc(C(=O)NCC2(C)CCCNC2)o1
InChIInChI=1S/C14H22N2O2/c1-3-11-5-6-12(18-11)13(17)16-10-14(2)7-4-8-15-9-14/h5-6,15H,3-4,7-10H2,1-2H3,(H,16,17)
InChIKeyQIKHYRMGAZNZBK-UHFFFAOYSA-N
XLogP1.96
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-N-[(1-hydroxycyclohexyl)methyl]furan-2-carboxamide
CID 64868940
N-[[1-(dimethylamino)cyclopentyl]methyl]-5-ethylfuran-2-carboxamide
CID 47031293
N-[[1-(aminomethyl)cyclopropyl]methyl]-5-ethylfuran-2-carboxamide
CID 115456771
3-methyl-N-[(3-methylpiperidin-3-yl)methyl]-1,2-oxazole-5-carboxamide
CID 113400462
5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide
CID 107422841
2,3-dihydroxy-N-[(3-methylpiperidin-3-yl)methyl]benzamide
CID 114345124
1-benzyl-3-[(3-methylpiperidin-3-yl)methyl]urea
CID 107654302
N-[(3-methylpiperidin-3-yl)methyl]pyridazine-4-carboxamide
CID 104671755
N-[(3-methylpiperidin-3-yl)methyl]-6-oxo-1H-pyridine-2-carboxamide
CID 114040294
N-(2-chloroprop-2-enyl)-5-ethylfuran-2-carboxamide
CID 115636695
4-[[(5-ethylfuran-2-carbonyl)amino]methyl]oxane-4-carboxylic acid
CID 115438391
5-chloro-N-[(3-methylpiperidin-3-yl)methyl]pyridine-2-carboxamide
CID 113400496

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide?
The IUPAC name of 5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide (CID 113400454) is 5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide?
The canonical SMILES for 5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide is CCc1ccc(C(=O)NCC2(C)CCCNC2)o1.
What is the InChIKey of 5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide?
The InChIKey is QIKHYRMGAZNZBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-11-5-6-12(18-11)13(17)16-10-14(2)7-4-8-15-9-14/h5-6,15H,3-4,7-10H2,1-2H3,(H,16,17).
What are the key properties of 5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide?
5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide has a molecular weight of 250.34 g/mol, XLogP of 1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide is sourced from PubChem (CID 113400454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).