N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide

C20H24N2O3 — CID 110820463

IUPACN-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide
SMILESCC(C)c1ccc(C(=O)N2CCC(NC(=O)c3ccco3)CC2)cc1
InChIInChI=1S/C20H24N2O3/c1-14(2)15-5-7-16(8-6-15)20(24)22-11-9-17(10-12-22)21-19(23)18-4-3-13-25-18/h3-8,13-14,17H,9-12H2,1-2H3,(H,21,23)
InChIKeyIZNCQWWXMYHPRA-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.44
Rot. Bonds4

About N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide

N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide (PubChem CID 110820463) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide
PubChem CID110820463
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide
SMILESCC(C)c1ccc(C(=O)N2CCC(NC(=O)c3ccco3)CC2)cc1
InChIInChI=1S/C20H24N2O3/c1-14(2)15-5-7-16(8-6-15)20(24)22-11-9-17(10-12-22)21-19(23)18-4-3-13-25-18/h3-8,13-14,17H,9-12H2,1-2H3,(H,21,23)
InChIKeyIZNCQWWXMYHPRA-UHFFFAOYSA-N
XLogP3.44
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-bromobenzoyl)piperidin-4-yl]furan-2-carboxamide
CID 108550026
N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide
CID 110821547
N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-methylbenzamide
CID 16613592
N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]acetamide
CID 49348928
4-tert-butyl-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]benzamide
CID 108561415
[4-(furan-2-carbonyl)-1,4-diazepan-1-yl]-(4-propan-2-ylphenyl)methanone
CID 110798012
N-[1-(3-chlorobenzoyl)piperidin-4-yl]-4-propan-2-ylbenzamide
CID 108564146
N-[1-[4-(methanesulfonamido)benzoyl]piperidin-4-yl]-4-propan-2-ylbenzamide
CID 108564764
N-[1-(2-phenylbutanoyl)piperidin-4-yl]furan-2-carboxamide
CID 51102722
N-[(2R)-1-[(1-benzoylpiperidin-4-yl)amino]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 51728586
N-[5-(4-benzamidopiperidine-1-carbonyl)-2-methylphenyl]furan-2-carboxamide
CID 37019545
2-chloro-N-[1-(furan-2-carbonyl)piperidin-4-yl]benzamide
CID 46420508

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide?
The IUPAC name of N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide (CID 110820463) is N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide.
What is the SMILES notation for N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide?
The canonical SMILES for N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide is CC(C)c1ccc(C(=O)N2CCC(NC(=O)c3ccco3)CC2)cc1.
What is the InChIKey of N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide?
The InChIKey is IZNCQWWXMYHPRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-14(2)15-5-7-16(8-6-15)20(24)22-11-9-17(10-12-22)21-19(23)18-4-3-13-25-18/h3-8,13-14,17H,9-12H2,1-2H3,(H,21,23).
What are the key properties of N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide?
N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide has a molecular weight of 340.42 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide is sourced from PubChem (CID 110820463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).