2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide

C9H20N2O4 — CID 81089598

IUPAC2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide
SMILESCOCC(O)CN(C)C(=O)C(N)COC
InChIInChI=1S/C9H20N2O4/c1-11(4-7(12)5-14-2)9(13)8(10)6-15-3/h7-8,12H,4-6,10H2,1-3H3
InChIKeyNZTVVISEPAKFIE-UHFFFAOYSA-N
MW220.27 g/mol
LogP-1.57
Rot. Bonds7

About 2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide

2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide (PubChem CID 81089598) has the molecular formula C9H20N2O4 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide
PubChem CID81089598
Molecular FormulaC9H20N2O4
Molecular Weight220.27 g/mol
Exact Mass220.14
IUPAC Name2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide
SMILESCOCC(O)CN(C)C(=O)C(N)COC
InChIInChI=1S/C9H20N2O4/c1-11(4-7(12)5-14-2)9(13)8(10)6-15-3/h7-8,12H,4-6,10H2,1-3H3
InChIKeyNZTVVISEPAKFIE-UHFFFAOYSA-N
XLogP-1.57
TPSA85.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 5-1.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-4-[(2-hydroxy-3-methoxypropyl)-methylamino]-4-oxobutanoic acid
CID 64895957
2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide
CID 76911278
(2S)-2-amino-N-(2-hydroxy-3-methoxypropyl)-N-methyl-4-phenylbutanamide
CID 104984250
3,3,3-trifluoro-N-(2-hydroxy-3-methoxypropyl)-N-methyl-2-(trifluoromethyl)propanamide
CID 103310159
N-(2-hydroxy-3-methoxypropyl)-N-methylbut-2-ynamide
CID 106741532
2-amino-3-methoxy-N-methyl-N-[2-(methylamino)-2-oxoethyl]propanamide
CID 81081950
2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide
CID 75392163
2-acetamido-N-(2-hydroxy-3-methoxypropyl)-N-methyl-3-sulfanylpropanamide
CID 107769331
3-amino-N-(2-hydroxy-3-methoxypropyl)-N,3-dimethylbutanamide
CID 64678232
N-(2-hydroxy-3-methoxypropyl)-2-methoxy-N,2-dimethylpropanamide
CID 103747204
2-amino-3-methoxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 81082656
2-amino-N-(2-hydroxy-3-methoxypropyl)-N,2-dimethylbutanamide
CID 79810651

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide?
The IUPAC name of 2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide (CID 81089598) is 2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide.
What is the SMILES notation for 2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide?
The canonical SMILES for 2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide is COCC(O)CN(C)C(=O)C(N)COC.
What is the InChIKey of 2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide?
The InChIKey is NZTVVISEPAKFIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O4/c1-11(4-7(12)5-14-2)9(13)8(10)6-15-3/h7-8,12H,4-6,10H2,1-3H3.
What are the key properties of 2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide?
2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide has a molecular weight of 220.27 g/mol, XLogP of -1.57, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide is sourced from PubChem (CID 81089598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).