N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

C23H28N4O3 — CID 46290154

IUPACN-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
SMILESCCOc1ccccc1NC(=O)C1CCN(c2nc(C)nc3oc(C)c(C)c23)CC1
InChIInChI=1S/C23H28N4O3/c1-5-29-19-9-7-6-8-18(19)26-22(28)17-10-12-27(13-11-17)21-20-14(2)15(3)30-23(20)25-16(4)24-21/h6-9,17H,5,10-13H2,1-4H3,(H,26,28)
InChIKeyNSJDPKMGOISJMY-UHFFFAOYSA-N
MW408.50 g/mol
LogP4.40
Rot. Bonds5

About N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide (PubChem CID 46290154) has the molecular formula C23H28N4O3 and a molecular weight of 408.50 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
PubChem CID46290154
Molecular FormulaC23H28N4O3
Molecular Weight408.50 g/mol
Exact Mass408.22
IUPAC NameN-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
SMILESCCOc1ccccc1NC(=O)C1CCN(c2nc(C)nc3oc(C)c(C)c23)CC1
InChIInChI=1S/C23H28N4O3/c1-5-29-19-9-7-6-8-18(19)26-22(28)17-10-12-27(13-11-17)21-20-14(2)15(3)30-23(20)25-16(4)24-21/h6-9,17H,5,10-13H2,1-4H3,(H,26,28)
InChIKeyNSJDPKMGOISJMY-UHFFFAOYSA-N
XLogP4.40
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.50
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide with MolForge

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Related Compounds

N-(2-ethylphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
CID 46290122
methyl 2-[[1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carbonyl]amino]benzoate
CID 46290126
N-(2-ethoxyphenyl)-1-(4-methylpyrrolo[1,2-d][1,2,4]triazin-1-yl)piperidine-4-carboxamide
CID 50840883
N-(3-methylbutyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
CID 46290139
N-(2,4-dimethoxyphenyl)-1-(5,6-dimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
CID 46289909
(3R)-1-(5,6-dimethylfuro[2,3-d]pyrimidin-4-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide
CID 92866341
1-(2-amino-2-oxoethyl)-N-(2-ethoxyphenyl)piperidine-4-carboxamide
CID 16909193
4-N-(2-ethoxyphenyl)-1-N-(2-methoxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109151014
N-[2-(cyclohexen-1-yl)ethyl]-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
CID 46290155
(3S)-N-(4-methylphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide
CID 92866568
1-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]-N-(2-ethoxyphenyl)piperidine-4-carboxamide
CID 90514251
N-(2-ethoxyphenyl)-1-(4-fluoro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
CID 90609549

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide (CID 46290154) is N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide is CCOc1ccccc1NC(=O)C1CCN(c2nc(C)nc3oc(C)c(C)c23)CC1.
What is the InChIKey of N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide?
The InChIKey is NSJDPKMGOISJMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O3/c1-5-29-19-9-7-6-8-18(19)26-22(28)17-10-12-27(13-11-17)21-20-14(2)15(3)30-23(20)25-16(4)24-21/h6-9,17H,5,10-13H2,1-4H3,(H,26,28).
What are the key properties of N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide?
N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide has a molecular weight of 408.50 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-1-(2,5,6-trimethylfuro[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide is sourced from PubChem (CID 46290154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).