2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide

C10H20N2O3 — CID 106100495

IUPAC2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide
SMILESCC(NCC1(O)CCOC1)C(=O)N(C)C
InChIInChI=1S/C10H20N2O3/c1-8(9(13)12(2)3)11-6-10(14)4-5-15-7-10/h8,11,14H,4-7H2,1-3H3
InChIKeyPZMCHDMMDSNCMK-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.80
Rot. Bonds4

About 2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide

2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide (PubChem CID 106100495) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide
PubChem CID106100495
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide
SMILESCC(NCC1(O)CCOC1)C(=O)N(C)C
InChIInChI=1S/C10H20N2O3/c1-8(9(13)12(2)3)11-6-10(14)4-5-15-7-10/h8,11,14H,4-7H2,1-3H3
InChIKeyPZMCHDMMDSNCMK-UHFFFAOYSA-N
XLogP-0.80
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(1-hydroxycycloheptyl)methylamino]-N,N-dimethylpropanamide
CID 54950879
1-(azepan-1-yl)-2-[(3-hydroxyoxolan-3-yl)methylamino]propan-1-one
CID 106100801
2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide
CID 65118585
methyl 3-[(3-hydroxyoxolan-3-yl)methylamino]-2-methylbutanoate
CID 106100572
2-[(3-hydroxyoxolan-3-yl)methylamino]-N-(4-methylphenyl)propanamide
CID 106100830
methyl 2-[(3-hydroxyoxolan-3-yl)methylamino]butanoate
CID 106100069
ethyl 3-[(3-hydroxyoxolan-3-yl)methylamino]butanoate
CID 106100665
2-amino-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide
CID 106101394
2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide
CID 103849532
2-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpropanamide
CID 105416686
3-amino-N-[(3-hydroxyoxolan-3-yl)methyl]-2-methylpropanamide
CID 106101303
2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N,N-dimethylpropanamide
CID 115359532

Frequently Asked Questions

What is the IUPAC name of 2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide (CID 106100495) is 2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide is CC(NCC1(O)CCOC1)C(=O)N(C)C.
What is the InChIKey of 2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide?
The InChIKey is PZMCHDMMDSNCMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-8(9(13)12(2)3)11-6-10(14)4-5-15-7-10/h8,11,14H,4-7H2,1-3H3.
What are the key properties of 2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide?
2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide has a molecular weight of 216.28 g/mol, XLogP of -0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide is sourced from PubChem (CID 106100495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).