N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide

C24H26N2O3 — CID 17390945

IUPACN-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide
SMILESO=C(NCC(c1ccco1)N1CCCC1)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H26N2O3/c27-24(25-17-22(23-9-6-16-28-23)26-14-4-5-15-26)20-10-12-21(13-11-20)29-18-19-7-2-1-3-8-19/h1-3,6-13,16,22H,4-5,14-15,17-18H2,(H,25,27)
InChIKeyUZZKDUDIDKNAIU-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.43
Rot. Bonds8

About N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide

N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide (PubChem CID 17390945) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide
PubChem CID17390945
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC NameN-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide
SMILESO=C(NCC(c1ccco1)N1CCCC1)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H26N2O3/c27-24(25-17-22(23-9-6-16-28-23)26-14-4-5-15-26)20-10-12-21(13-11-20)29-18-19-7-2-1-3-8-19/h1-3,6-13,16,22H,4-5,14-15,17-18H2,(H,25,27)
InChIKeyUZZKDUDIDKNAIU-UHFFFAOYSA-N
XLogP4.43
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide?
The IUPAC name of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide (CID 17390945) is N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide is O=C(NCC(c1ccco1)N1CCCC1)c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide?
The InChIKey is UZZKDUDIDKNAIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c27-24(25-17-22(23-9-6-16-28-23)26-14-4-5-15-26)20-10-12-21(13-11-20)29-18-19-7-2-1-3-8-19/h1-3,6-13,16,22H,4-5,14-15,17-18H2,(H,25,27).
What are the key properties of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide?
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide has a molecular weight of 390.48 g/mol, XLogP of 4.43, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-phenylmethoxybenzamide is sourced from PubChem (CID 17390945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).