2-[(3-methoxyoxolan-3-yl)methylamino]propanamide

C9H18N2O3 — CID 104704803

IUPAC2-[(3-methoxyoxolan-3-yl)methylamino]propanamide
SMILESCOC1(CNC(C)C(N)=O)CCOC1
InChIInChI=1S/C9H18N2O3/c1-7(8(10)12)11-5-9(13-2)3-4-14-6-9/h7,11H,3-6H2,1-2H3,(H2,10,12)
InChIKeyRVXKHUIUTQANTN-UHFFFAOYSA-N
MW202.25 g/mol
LogP-0.74
Rot. Bonds5

About 2-[(3-methoxyoxolan-3-yl)methylamino]propanamide

2-[(3-methoxyoxolan-3-yl)methylamino]propanamide (PubChem CID 104704803) has the molecular formula C9H18N2O3 and a molecular weight of 202.25 g/mol. Its IUPAC name is 2-[(3-methoxyoxolan-3-yl)methylamino]propanamide.

Molecular Properties

Compound Name2-[(3-methoxyoxolan-3-yl)methylamino]propanamide
PubChem CID104704803
Molecular FormulaC9H18N2O3
Molecular Weight202.25 g/mol
Exact Mass202.13
IUPAC Name2-[(3-methoxyoxolan-3-yl)methylamino]propanamide
SMILESCOC1(CNC(C)C(N)=O)CCOC1
InChIInChI=1S/C9H18N2O3/c1-7(8(10)12)11-5-9(13-2)3-4-14-6-9/h7,11H,3-6H2,1-2H3,(H2,10,12)
InChIKeyRVXKHUIUTQANTN-UHFFFAOYSA-N
XLogP-0.74
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-methoxyoxolan-3-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide
CID 104704812
N-[(3-methoxyoxolan-3-yl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 104709176
2-[(3-methoxyoxolan-3-yl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 113450181
2-amino-3,3,3-trifluoro-N-[(3-methoxyoxolan-3-yl)methyl]-2-methylpropanamide
CID 113450267
2-(Oxolan-3-ylmethylamino)propanamide
CID 43545359
N-(2-methoxyethyl)-2-(oxolan-3-ylmethylamino)propanamide
CID 61039704
N-(1-methoxypropan-2-yl)-2-(oxolan-3-ylmethylamino)acetamide
CID 61488394
2-Methyl-2-(oxolan-3-ylamino)propanamide
CID 63335700
2-(Ethylamino)-3-(oxolan-3-yloxy)propanamide
CID 63556308
3-(Oxolan-3-yloxy)-2-(propylamino)propanamide
CID 63556310
2-(Cyclopropylamino)-2-methyl-3-(oxolan-3-yloxy)propanamide
CID 63556313
2-Methyl-4-(oxolan-3-yloxy)-2-(propan-2-ylamino)butanamide
CID 63556315

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxyoxolan-3-yl)methylamino]propanamide?
The IUPAC name of 2-[(3-methoxyoxolan-3-yl)methylamino]propanamide (CID 104704803) is 2-[(3-methoxyoxolan-3-yl)methylamino]propanamide.
What is the SMILES notation for 2-[(3-methoxyoxolan-3-yl)methylamino]propanamide?
The canonical SMILES for 2-[(3-methoxyoxolan-3-yl)methylamino]propanamide is COC1(CNC(C)C(N)=O)CCOC1.
What is the InChIKey of 2-[(3-methoxyoxolan-3-yl)methylamino]propanamide?
The InChIKey is RVXKHUIUTQANTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3/c1-7(8(10)12)11-5-9(13-2)3-4-14-6-9/h7,11H,3-6H2,1-2H3,(H2,10,12).
What are the key properties of 2-[(3-methoxyoxolan-3-yl)methylamino]propanamide?
2-[(3-methoxyoxolan-3-yl)methylamino]propanamide has a molecular weight of 202.25 g/mol, XLogP of -0.74, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxyoxolan-3-yl)methylamino]propanamide is sourced from PubChem (CID 104704803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).