1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one

C14H18N2O3 — CID 43733450

IUPAC1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one
SMILESCOCCn1cc(NCc2ccc(C)o2)ccc1=O
InChIInChI=1S/C14H18N2O3/c1-11-3-5-13(19-11)9-15-12-4-6-14(17)16(10-12)7-8-18-2/h3-6,10,15H,7-9H2,1-2H3
InChIKeyIBUNDZZAVLPIHS-UHFFFAOYSA-N
MW262.31 g/mol
LogP2.01
Rot. Bonds6

About 1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one

1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one (PubChem CID 43733450) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one.

Molecular Properties

Compound Name1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one
PubChem CID43733450
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one
SMILESCOCCn1cc(NCc2ccc(C)o2)ccc1=O
InChIInChI=1S/C14H18N2O3/c1-11-3-5-13(19-11)9-15-12-4-6-14(17)16(10-12)7-8-18-2/h3-6,10,15H,7-9H2,1-2H3
InChIKeyIBUNDZZAVLPIHS-UHFFFAOYSA-N
XLogP2.01
TPSA56.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one?
The IUPAC name of 1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one (CID 43733450) is 1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one.
What is the SMILES notation for 1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one?
The canonical SMILES for 1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one is COCCn1cc(NCc2ccc(C)o2)ccc1=O.
What is the InChIKey of 1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one?
The InChIKey is IBUNDZZAVLPIHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-11-3-5-13(19-11)9-15-12-4-6-14(17)16(10-12)7-8-18-2/h3-6,10,15H,7-9H2,1-2H3.
What are the key properties of 1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one?
1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one has a molecular weight of 262.31 g/mol, XLogP of 2.01, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one is sourced from PubChem (CID 43733450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).