1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one

C13H20N2O2 — CID 137449430

IUPAC1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one
SMILESCC(C)Nc1cccn(CCOC2CC2)c1=O
InChIInChI=1S/C13H20N2O2/c1-10(2)14-12-4-3-7-15(13(12)16)8-9-17-11-5-6-11/h3-4,7,10-11,14H,5-6,8-9H2,1-2H3
InChIKeyYGYGWGOBNFFUCX-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.85
Rot. Bonds6

About 1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one

1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one (PubChem CID 137449430) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one.

Molecular Properties

Compound Name1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one
PubChem CID137449430
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one
SMILESCC(C)Nc1cccn(CCOC2CC2)c1=O
InChIInChI=1S/C13H20N2O2/c1-10(2)14-12-4-3-7-15(13(12)16)8-9-17-11-5-6-11/h3-4,7,10-11,14H,5-6,8-9H2,1-2H3
InChIKeyYGYGWGOBNFFUCX-UHFFFAOYSA-N
XLogP1.85
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 ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Ethyl 2-(3-acetamido-2-oxo-1-pyridinyl)acetate
CID 10444200
Ethyl 2-[2-oxo-3-(propylamino)-1-pyridinyl]acetate
CID 45271635
N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-6-oxo-1H-pyridine-2-carboxamide
CID 132360567
2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide
CID 63826173
N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958114
2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(2,2-difluoroethoxy)ethyl]acetamide
CID 105904156
1-[1-Methoxy-2-(propan-2-ylamino)ethyl]pyridin-2-one
CID 134278026
1-[(1S,2S)-2-methoxycyclobutyl]-3-(propan-2-ylamino)pyridin-2-one
CID 137449043
1-[(3R,4R)-3-methoxyoxan-4-yl]-3-(propan-2-ylamino)pyridin-2-one
CID 137449048
1-(2-Methoxyethyl)-3-(methylamino)pyridin-2-one
CID 137449062
1-[(1R,2R)-2-methoxycyclobutyl]-3-(propan-2-ylamino)pyridin-2-one
CID 137449063
3-(methylamino)-1-[(3S)-oxolan-3-yl]pyridin-2-one
CID 137449099

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one?
The IUPAC name of 1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one (CID 137449430) is 1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one.
What is the SMILES notation for 1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one?
The canonical SMILES for 1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one is CC(C)Nc1cccn(CCOC2CC2)c1=O.
What is the InChIKey of 1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one?
The InChIKey is YGYGWGOBNFFUCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10(2)14-12-4-3-7-15(13(12)16)8-9-17-11-5-6-11/h3-4,7,10-11,14H,5-6,8-9H2,1-2H3.
What are the key properties of 1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one?
1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one has a molecular weight of 236.31 g/mol, XLogP of 1.85, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropyloxyethyl)-3-(propan-2-ylamino)pyridin-2-one is sourced from PubChem (CID 137449430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).