N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide

C19H23N3O3 — CID 110821547

IUPACN-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide
SMILESCN(C)c1ccc(C(=O)N2CCC(NC(=O)c3ccco3)CC2)cc1
InChIInChI=1S/C19H23N3O3/c1-21(2)16-7-5-14(6-8-16)19(24)22-11-9-15(10-12-22)20-18(23)17-4-3-13-25-17/h3-8,13,15H,9-12H2,1-2H3,(H,20,23)
InChIKeyIHVKPTYWIGTCJE-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.38
Rot. Bonds4

About N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide

N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide (PubChem CID 110821547) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide
PubChem CID110821547
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide
SMILESCN(C)c1ccc(C(=O)N2CCC(NC(=O)c3ccco3)CC2)cc1
InChIInChI=1S/C19H23N3O3/c1-21(2)16-7-5-14(6-8-16)19(24)22-11-9-15(10-12-22)20-18(23)17-4-3-13-25-17/h3-8,13,15H,9-12H2,1-2H3,(H,20,23)
InChIKeyIHVKPTYWIGTCJE-UHFFFAOYSA-N
XLogP2.38
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-bromobenzoyl)piperidin-4-yl]furan-2-carboxamide
CID 108550026
N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]furan-2-carboxamide
CID 110820463
N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-methylbenzamide
CID 16613592
4-(dimethylamino)-N-[1-(3,4-dimethylbenzoyl)piperidin-4-yl]benzamide
CID 108557983
4-(dimethylamino)-N-[1-(3-methylbenzoyl)piperidin-4-yl]benzamide
CID 108557963
2,5-dichloro-N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]benzamide
CID 108554641
N-[5-(4-benzamidopiperidine-1-carbonyl)-2-methylphenyl]furan-2-carboxamide
CID 37019545
3-chloro-N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]propanamide
CID 108567076
N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]-2,3-dimethylquinoxaline-6-carboxamide
CID 108554445
N-[(2R)-1-[(1-benzoylpiperidin-4-yl)amino]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 51728586
2-[[1-(furan-2-carbonyl)piperidin-4-yl]carbamoyl]benzoic acid
CID 113083174
N-[1-[2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carbonyl]piperidin-4-yl]furan-2-carboxamide
CID 108550040

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide?
The IUPAC name of N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide (CID 110821547) is N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide.
What is the SMILES notation for N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide?
The canonical SMILES for N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide is CN(C)c1ccc(C(=O)N2CCC(NC(=O)c3ccco3)CC2)cc1.
What is the InChIKey of N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide?
The InChIKey is IHVKPTYWIGTCJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-21(2)16-7-5-14(6-8-16)19(24)22-11-9-15(10-12-22)20-18(23)17-4-3-13-25-17/h3-8,13,15H,9-12H2,1-2H3,(H,20,23).
What are the key properties of N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide?
N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide is sourced from PubChem (CID 110821547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).