1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one

C15H22N4O2 — CID 43733397

IUPAC1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one
SMILESCOCCn1cc(NCc2c(C)nn(C)c2C)ccc1=O
InChIInChI=1S/C15H22N4O2/c1-11-14(12(2)18(3)17-11)9-16-13-5-6-15(20)19(10-13)7-8-21-4/h5-6,10,16H,7-9H2,1-4H3
InChIKeyQCIPZQDMJWGXDJ-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.46
Rot. Bonds6

About 1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one

1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one (PubChem CID 43733397) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one.

Molecular Properties

Compound Name1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one
PubChem CID43733397
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one
SMILESCOCCn1cc(NCc2c(C)nn(C)c2C)ccc1=O
InChIInChI=1S/C15H22N4O2/c1-11-14(12(2)18(3)17-11)9-16-13-5-6-15(20)19(10-13)7-8-21-4/h5-6,10,16H,7-9H2,1-4H3
InChIKeyQCIPZQDMJWGXDJ-UHFFFAOYSA-N
XLogP1.46
TPSA61.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one?
The IUPAC name of 1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one (CID 43733397) is 1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one.
What is the SMILES notation for 1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one?
The canonical SMILES for 1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one is COCCn1cc(NCc2c(C)nn(C)c2C)ccc1=O.
What is the InChIKey of 1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one?
The InChIKey is QCIPZQDMJWGXDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-11-14(12(2)18(3)17-11)9-16-13-5-6-15(20)19(10-13)7-8-21-4/h5-6,10,16H,7-9H2,1-4H3.
What are the key properties of 1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one?
1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one has a molecular weight of 290.37 g/mol, XLogP of 1.46, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-5-[(1,3,5-trimethylpyrazol-4-yl)methylamino]pyridin-2-one is sourced from PubChem (CID 43733397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).