(2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide

C17H17N3O3 — CID 99636760

IUPAC(2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide
SMILESO=C(NCc1ccco1)[C@H]1CCCN1c1nccc2occc12
InChIInChI=1S/C17H17N3O3/c21-17(19-11-12-3-2-9-22-12)14-4-1-8-20(14)16-13-6-10-23-15(13)5-7-18-16/h2-3,5-7,9-10,14H,1,4,8,11H2,(H,19,21)/t14-/m1/s1
InChIKeySFPOSPYCTKCZMQ-CQSZACIVSA-N
MW311.34 g/mol
LogP2.71
Rot. Bonds4

About (2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide

(2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide (PubChem CID 99636760) has the molecular formula C17H17N3O3 and a molecular weight of 311.34 g/mol. Its IUPAC name is (2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide
PubChem CID99636760
Molecular FormulaC17H17N3O3
Molecular Weight311.34 g/mol
Exact Mass311.13
IUPAC Name(2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide
SMILESO=C(NCc1ccco1)[C@H]1CCCN1c1nccc2occc12
InChIInChI=1S/C17H17N3O3/c21-17(19-11-12-3-2-9-22-12)14-4-1-8-20(14)16-13-6-10-23-15(13)5-7-18-16/h2-3,5-7,9-10,14H,1,4,8,11H2,(H,19,21)/t14-/m1/s1
InChIKeySFPOSPYCTKCZMQ-CQSZACIVSA-N
XLogP2.71
TPSA71.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide (CID 99636760) is (2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide is O=C(NCc1ccco1)[C@H]1CCCN1c1nccc2occc12.
What is the InChIKey of (2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide?
The InChIKey is SFPOSPYCTKCZMQ-CQSZACIVSA-N. The full InChI is InChI=1S/C17H17N3O3/c21-17(19-11-12-3-2-9-22-12)14-4-1-8-20(14)16-13-6-10-23-15(13)5-7-18-16/h2-3,5-7,9-10,14H,1,4,8,11H2,(H,19,21)/t14-/m1/s1.
What are the key properties of (2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide?
(2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide has a molecular weight of 311.34 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(furan-2-ylmethyl)-1-furo[3,2-c]pyridin-4-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 99636760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).