[2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone

C16H19N3O2 — CID 134709793

IUPAC[2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1ccnc(NCCc2ccco2)c1)N1CCCC1
InChIInChI=1S/C16H19N3O2/c20-16(19-9-1-2-10-19)13-5-7-17-15(12-13)18-8-6-14-4-3-11-21-14/h3-5,7,11-12H,1-2,6,8-10H2,(H,17,18)
InChIKeyFRCINBKPJHLFNN-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.57
Rot. Bonds5

About [2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone

[2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone (PubChem CID 134709793) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is [2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone
PubChem CID134709793
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name[2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1ccnc(NCCc2ccco2)c1)N1CCCC1
InChIInChI=1S/C16H19N3O2/c20-16(19-9-1-2-10-19)13-5-7-17-15(12-13)18-8-6-14-4-3-11-21-14/h3-5,7,11-12H,1-2,6,8-10H2,(H,17,18)
InChIKeyFRCINBKPJHLFNN-UHFFFAOYSA-N
XLogP2.57
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-chloro-6-[2-(furan-2-yl)ethylamino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133270752
[2-(furan-2-ylmethylamino)-4-pyridinyl]-(4-phenylpiperazin-1-yl)methanone
CID 109169331
[2-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethylamino]-4-pyridinyl]-piperidin-1-ylmethanone
CID 135115677
(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[2-(furan-2-ylmethylamino)-4-pyridinyl]methanone
CID 109169350
piperidin-1-yl-[2-[2-(1,2,4-triazol-1-yl)ethylamino]-4-pyridinyl]methanone
CID 135092689
[2-(3-cyclohexyloxypropylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone
CID 135112899
1-[4-[2-(3-phenylpropylamino)pyridine-4-carbonyl]piperazin-1-yl]ethanone
CID 109169044
1-[4-[2-[2-(3-chlorophenyl)ethylamino]pyridine-4-carbonyl]piperazin-1-yl]ethanone
CID 109169047
[2-(cyclopentylamino)-4-pyridinyl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone
CID 109166110
azepan-1-yl-[2-(furan-2-ylmethylamino)pyrimidin-4-yl]methanone
CID 109303309
N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide
CID 62172710
[2-[(3-chloro-2-methylphenyl)methylamino]-4-pyridinyl]-piperidin-1-ylmethanone
CID 134710185

Frequently Asked Questions

What is the IUPAC name of [2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone (CID 134709793) is [2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone is O=C(c1ccnc(NCCc2ccco2)c1)N1CCCC1.
What is the InChIKey of [2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone?
The InChIKey is FRCINBKPJHLFNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c20-16(19-9-1-2-10-19)13-5-7-17-15(12-13)18-8-6-14-4-3-11-21-14/h3-5,7,11-12H,1-2,6,8-10H2,(H,17,18).
What are the key properties of [2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone?
[2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone has a molecular weight of 285.35 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(furan-2-yl)ethylamino]-4-pyridinyl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 134709793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).