N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide

C21H25N3O4 — CID 55679309

IUPACN-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
SMILESO=C(NCc1ccnc(OC2CCCC2)c1)C1CC(=O)N(Cc2ccco2)C1
InChIInChI=1S/C21H25N3O4/c25-20-11-16(13-24(20)14-18-6-3-9-27-18)21(26)23-12-15-7-8-22-19(10-15)28-17-4-1-2-5-17/h3,6-10,16-17H,1-2,4-5,11-14H2,(H,23,26)
InChIKeyOQYGZCOUBCZBPX-UHFFFAOYSA-N
MW383.45 g/mol
LogP2.66
Rot. Bonds7

About N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide

N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 55679309) has the molecular formula C21H25N3O4 and a molecular weight of 383.45 g/mol. Its IUPAC name is N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID55679309
Molecular FormulaC21H25N3O4
Molecular Weight383.45 g/mol
Exact Mass383.18
IUPAC NameN-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
SMILESO=C(NCc1ccnc(OC2CCCC2)c1)C1CC(=O)N(Cc2ccco2)C1
InChIInChI=1S/C21H25N3O4/c25-20-11-16(13-24(20)14-18-6-3-9-27-18)21(26)23-12-15-7-8-22-19(10-15)28-17-4-1-2-5-17/h3,6-10,16-17H,1-2,4-5,11-14H2,(H,23,26)
InChIKeyOQYGZCOUBCZBPX-UHFFFAOYSA-N
XLogP2.66
TPSA84.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-1-(furan-2-ylmethyl)-5-oxo-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]pyrrolidine-3-carboxamide
CID 37053630
N-cyclopentyl-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 47100703
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 55659080
(3R)-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 95237254
(3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
CID 94170855
(3S)-N-(furan-2-ylmethyl)-5-oxo-1-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
CID 94021658
1-(furan-2-ylmethyl)-5-oxo-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]pyrrolidine-3-carboxamide
CID 51237853
1-(furan-2-ylmethyl)-N-[[3-[(3-methylphenyl)carbamoylamino]phenyl]methyl]-5-oxopyrrolidine-3-carboxamide
CID 55957406
1-(furan-2-ylmethyl)-5-oxo-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-3-carboxamide
CID 42881863
1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide
CID 47099759
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-3-carbonyl)piperidine-4-carboxamide
CID 55659546
methyl (3S)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxylate
CID 42579834

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide (CID 55679309) is N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide is O=C(NCc1ccnc(OC2CCCC2)c1)C1CC(=O)N(Cc2ccco2)C1.
What is the InChIKey of N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is OQYGZCOUBCZBPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O4/c25-20-11-16(13-24(20)14-18-6-3-9-27-18)21(26)23-12-15-7-8-22-19(10-15)28-17-4-1-2-5-17/h3,6-10,16-17H,1-2,4-5,11-14H2,(H,23,26).
What are the key properties of N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide?
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 383.45 g/mol, XLogP of 2.66, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 55679309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).