N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide

C18H23N3O4 — CID 25163884

IUPACN-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide
SMILESO=C(CNC(=O)c1ccco1)NCC(c1ccco1)N1CCCCC1
InChIInChI=1S/C18H23N3O4/c22-17(13-20-18(23)16-7-5-11-25-16)19-12-14(15-6-4-10-24-15)21-8-2-1-3-9-21/h4-7,10-11,14H,1-3,8-9,12-13H2,(H,19,22)(H,20,23)
InChIKeyKOWAPTVGFHXFDJ-UHFFFAOYSA-N
MW345.40 g/mol
LogP1.95
Rot. Bonds7

About N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide

N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide (PubChem CID 25163884) has the molecular formula C18H23N3O4 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide
PubChem CID25163884
Molecular FormulaC18H23N3O4
Molecular Weight345.40 g/mol
Exact Mass345.17
IUPAC NameN-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide
SMILESO=C(CNC(=O)c1ccco1)NCC(c1ccco1)N1CCCCC1
InChIInChI=1S/C18H23N3O4/c22-17(13-20-18(23)16-7-5-11-25-16)19-12-14(15-6-4-10-24-15)21-8-2-1-3-9-21/h4-7,10-11,14H,1-3,8-9,12-13H2,(H,19,22)(H,20,23)
InChIKeyKOWAPTVGFHXFDJ-UHFFFAOYSA-N
XLogP1.95
TPSA87.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide?
The IUPAC name of N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide (CID 25163884) is N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide is O=C(CNC(=O)c1ccco1)NCC(c1ccco1)N1CCCCC1.
What is the InChIKey of N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide?
The InChIKey is KOWAPTVGFHXFDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O4/c22-17(13-20-18(23)16-7-5-11-25-16)19-12-14(15-6-4-10-24-15)21-8-2-1-3-9-21/h4-7,10-11,14H,1-3,8-9,12-13H2,(H,19,22)(H,20,23).
What are the key properties of N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide?
N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide has a molecular weight of 345.40 g/mol, XLogP of 1.95, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]furan-2-carboxamide is sourced from PubChem (CID 25163884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).