[1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone

C19H23N3O3 — CID 56826414

IUPAC[1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
SMILESCc1ccc2oc(C(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2n1
InChIInChI=1S/C19H23N3O3/c1-13-4-5-16-15(20-13)12-17(25-16)19(24)22-10-6-14(7-11-22)18(23)21-8-2-3-9-21/h4-5,12,14H,2-3,6-11H2,1H3
InChIKeySCDCVZGXPLQQNM-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.61
Rot. Bonds2

About [1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone

[1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone (PubChem CID 56826414) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is [1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
PubChem CID56826414
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name[1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
SMILESCc1ccc2oc(C(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2n1
InChIInChI=1S/C19H23N3O3/c1-13-4-5-16-15(20-13)12-17(25-16)19(24)22-10-6-14(7-11-22)18(23)21-8-2-3-9-21/h4-5,12,14H,2-3,6-11H2,1H3
InChIKeySCDCVZGXPLQQNM-UHFFFAOYSA-N
XLogP2.61
TPSA66.65 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone (CID 56826414) is [1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone is Cc1ccc2oc(C(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2n1.
What is the InChIKey of [1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone?
The InChIKey is SCDCVZGXPLQQNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-13-4-5-16-15(20-13)12-17(25-16)19(24)22-10-6-14(7-11-22)18(23)21-8-2-3-9-21/h4-5,12,14H,2-3,6-11H2,1H3.
What are the key properties of [1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone?
[1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone has a molecular weight of 341.41 g/mol, XLogP of 2.61, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-methylfuro[3,2-b]pyridine-2-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 56826414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).