[4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone

C15H17N3O3 — CID 109206395

IUPAC[4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone
SMILESO=C(c1cc(NCc2ccco2)ccn1)N1CCOCC1
InChIInChI=1S/C15H17N3O3/c19-15(18-5-8-20-9-6-18)14-10-12(3-4-16-14)17-11-13-2-1-7-21-13/h1-4,7,10H,5-6,8-9,11H2,(H,16,17)
InChIKeyZPNIZMONLMSUEZ-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.76
Rot. Bonds4

About [4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone

[4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone (PubChem CID 109206395) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is [4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone
PubChem CID109206395
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name[4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone
SMILESO=C(c1cc(NCc2ccco2)ccn1)N1CCOCC1
InChIInChI=1S/C15H17N3O3/c19-15(18-5-8-20-9-6-18)14-10-12(3-4-16-14)17-11-13-2-1-7-21-13/h1-4,7,10H,5-6,8-9,11H2,(H,16,17)
InChIKeyZPNIZMONLMSUEZ-UHFFFAOYSA-N
XLogP1.76
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone?
The IUPAC name of [4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone (CID 109206395) is [4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone?
The canonical SMILES for [4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone is O=C(c1cc(NCc2ccco2)ccn1)N1CCOCC1.
What is the InChIKey of [4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone?
The InChIKey is ZPNIZMONLMSUEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c19-15(18-5-8-20-9-6-18)14-10-12(3-4-16-14)17-11-13-2-1-7-21-13/h1-4,7,10H,5-6,8-9,11H2,(H,16,17).
What are the key properties of [4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone?
[4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone has a molecular weight of 287.32 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(furan-2-ylmethylamino)-2-pyridinyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 109206395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).