1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one

C14H24N2O2 — CID 82524808

IUPAC1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one
SMILESCOCCn1c(C)ccc(CNCC(C)C)c1=O
InChIInChI=1S/C14H24N2O2/c1-11(2)9-15-10-13-6-5-12(3)16(14(13)17)7-8-18-4/h5-6,11,15H,7-10H2,1-4H3
InChIKeyFROWAOJLDMBJNI-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.55
Rot. Bonds7

About 1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one

1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one (PubChem CID 82524808) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one.

Molecular Properties

Compound Name1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one
PubChem CID82524808
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one
SMILESCOCCn1c(C)ccc(CNCC(C)C)c1=O
InChIInChI=1S/C14H24N2O2/c1-11(2)9-15-10-13-6-5-12(3)16(14(13)17)7-8-18-4/h5-6,11,15H,7-10H2,1-4H3
InChIKeyFROWAOJLDMBJNI-UHFFFAOYSA-N
XLogP1.55
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-tert-butyl-1-(2-methoxyethyl)-3-[(2-methylpropylamino)methyl]pyridin-2-one
CID 82523492
3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one
CID 82524810
3-(aminomethyl)-1-(2-methoxyethyl)-6-methylpyridin-2-one
CID 82188978
3-(butylaminomethyl)-1-(3-methoxypropyl)-6-methylpyridin-2-one
CID 82524753
1-(3-methylbutyl)-3-[(2-methylpropylamino)methyl]-6-propan-2-ylpyridin-2-one
CID 82524193
3-(ethylaminomethyl)-6-methyl-1-propylpyridin-2-one
CID 82525370
3-[(cyclopropylamino)methyl]-1-(3-methoxypropyl)-6-methylpyridin-2-one
CID 82524754
1-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one
CID 82527314
1-(3-methoxypropyl)-3-[(2-methylpropylamino)methyl]-5,6,7,8-tetrahydroquinolin-2-one
CID 82522193
1-butyl-6-methyl-3-(propylaminomethyl)pyridin-2-one
CID 82525151
1-butyl-3-[(2-methoxyethylamino)methyl]-6-propan-2-ylpyridin-2-one
CID 82524343
6-(2,5-dimethylphenyl)-1-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one
CID 82519945

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one?
The IUPAC name of 1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one (CID 82524808) is 1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one.
What is the SMILES notation for 1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one?
The canonical SMILES for 1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one is COCCn1c(C)ccc(CNCC(C)C)c1=O.
What is the InChIKey of 1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one?
The InChIKey is FROWAOJLDMBJNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-11(2)9-15-10-13-6-5-12(3)16(14(13)17)7-8-18-4/h5-6,11,15H,7-10H2,1-4H3.
What are the key properties of 1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one?
1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one has a molecular weight of 252.36 g/mol, XLogP of 1.55, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one is sourced from PubChem (CID 82524808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).