3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one

C13H20N2O2 — CID 82524810

IUPAC3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one
SMILESCOCCn1c(C)ccc(CNC2CC2)c1=O
InChIInChI=1S/C13H20N2O2/c1-10-3-4-11(9-14-12-5-6-12)13(16)15(10)7-8-17-2/h3-4,12,14H,5-9H2,1-2H3
InChIKeyGAUYXZFGGGFLAJ-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.06
Rot. Bonds6

About 3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one

3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one (PubChem CID 82524810) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one.

Molecular Properties

Compound Name3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one
PubChem CID82524810
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one
SMILESCOCCn1c(C)ccc(CNC2CC2)c1=O
InChIInChI=1S/C13H20N2O2/c1-10-3-4-11(9-14-12-5-6-12)13(16)15(10)7-8-17-2/h3-4,12,14H,5-9H2,1-2H3
InChIKeyGAUYXZFGGGFLAJ-UHFFFAOYSA-N
XLogP1.06
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(cyclopropylamino)methyl]-1-(3-methoxypropyl)-6-methylpyridin-2-one
CID 82524754
1-(2-methoxyethyl)-6-methyl-3-[(2-methylpropylamino)methyl]pyridin-2-one
CID 82524808
3-(aminomethyl)-1-(2-methoxyethyl)-6-methylpyridin-2-one
CID 82188978
3-[(cyclopentylamino)methyl]-6-methyl-1-(2-methylpropyl)pyridin-2-one
CID 82525035
3-(butylaminomethyl)-1-(3-methoxypropyl)-6-methylpyridin-2-one
CID 82524753
N-[[3-(2-methoxyethyl)-2-methylimidazol-4-yl]methyl]cyclopropanamine
CID 65172121
3-[(cyclopropylamino)methyl]-6-(2,4-dimethylphenyl)-1-propylpyridin-2-one
CID 82520275
N-[[2-ethyl-5-(3-methoxypropyl)phenyl]methyl]cyclopropanamine
CID 66899598
3-[(cyclopropylamino)methyl]-1-(3-methoxypropyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-one
CID 82521754
6-tert-butyl-3-[(cyclopropylamino)methyl]-1-(2-methylpropyl)pyridin-2-one
CID 82523674
3-[(cyclopropylamino)methyl]-1-methyl-6-phenylpyridin-2-one
CID 82521328
3-[(cyclopropylamino)methyl]-6-(3,4-dimethylphenyl)-1-methylpyridin-2-one
CID 82520145

Frequently Asked Questions

What is the IUPAC name of 3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one?
The IUPAC name of 3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one (CID 82524810) is 3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one.
What is the SMILES notation for 3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one?
The canonical SMILES for 3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one is COCCn1c(C)ccc(CNC2CC2)c1=O.
What is the InChIKey of 3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one?
The InChIKey is GAUYXZFGGGFLAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10-3-4-11(9-14-12-5-6-12)13(16)15(10)7-8-17-2/h3-4,12,14H,5-9H2,1-2H3.
What are the key properties of 3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one?
3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one has a molecular weight of 236.31 g/mol, XLogP of 1.06, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(cyclopropylamino)methyl]-1-(2-methoxyethyl)-6-methylpyridin-2-one is sourced from PubChem (CID 82524810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).