N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide

C19H23N3O3 — CID 119388874

IUPACN-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide
SMILESO=C(NC(Cc1ccccc1)C(=O)NC1CCNCC1)c1ccco1
InChIInChI=1S/C19H23N3O3/c23-18(21-15-8-10-20-11-9-15)16(13-14-5-2-1-3-6-14)22-19(24)17-7-4-12-25-17/h1-7,12,15-16,20H,8-11,13H2,(H,21,23)(H,22,24)
InChIKeyRHZHGMZYRUXJSD-UHFFFAOYSA-N
MW341.41 g/mol
LogP1.49
Rot. Bonds6

About N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide

N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide (PubChem CID 119388874) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide
PubChem CID119388874
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide
SMILESO=C(NC(Cc1ccccc1)C(=O)NC1CCNCC1)c1ccco1
InChIInChI=1S/C19H23N3O3/c23-18(21-15-8-10-20-11-9-15)16(13-14-5-2-1-3-6-14)22-19(24)17-7-4-12-25-17/h1-7,12,15-16,20H,8-11,13H2,(H,21,23)(H,22,24)
InChIKeyRHZHGMZYRUXJSD-UHFFFAOYSA-N
XLogP1.49
TPSA83.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide?
The IUPAC name of N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide (CID 119388874) is N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide is O=C(NC(Cc1ccccc1)C(=O)NC1CCNCC1)c1ccco1.
What is the InChIKey of N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide?
The InChIKey is RHZHGMZYRUXJSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c23-18(21-15-8-10-20-11-9-15)16(13-14-5-2-1-3-6-14)22-19(24)17-7-4-12-25-17/h1-7,12,15-16,20H,8-11,13H2,(H,21,23)(H,22,24).
What are the key properties of N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide?
N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 1.49, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-oxo-3-phenyl-1-(piperidin-4-ylamino)propan-2-yl]furan-2-carboxamide is sourced from PubChem (CID 119388874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).