3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide

C8H17N3O3 — CID 106174475

IUPAC3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide
SMILESCC(NCC(O)C(N)=O)C(=O)N(C)C
InChIInChI=1S/C8H17N3O3/c1-5(8(14)11(2)3)10-4-6(12)7(9)13/h5-6,10,12H,4H2,1-3H3,(H2,9,13)
InChIKeyHVDUNWIHNIFUST-UHFFFAOYSA-N
MW203.24 g/mol
LogP-2.10
Rot. Bonds5

About 3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide

3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide (PubChem CID 106174475) has the molecular formula C8H17N3O3 and a molecular weight of 203.24 g/mol. Its IUPAC name is 3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide.

Molecular Properties

Compound Name3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide
PubChem CID106174475
Molecular FormulaC8H17N3O3
Molecular Weight203.24 g/mol
Exact Mass203.13
IUPAC Name3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide
SMILESCC(NCC(O)C(N)=O)C(=O)N(C)C
InChIInChI=1S/C8H17N3O3/c1-5(8(14)11(2)3)10-4-6(12)7(9)13/h5-6,10,12H,4H2,1-3H3,(H2,9,13)
InChIKeyHVDUNWIHNIFUST-UHFFFAOYSA-N
XLogP-2.10
TPSA95.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 5-2.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-hydroxybutylamino)-N,N-dimethylpropanamide
CID 61464462
(2S)-2-(2-hydroxyethylamino)-N,N-dimethylpropanamide
CID 86625703
2-[2-(carbamoylamino)ethylamino]-N,N-dimethylpropanamide
CID 83120649
2-[[3-(diethylamino)-2-hydroxypropyl]amino]-N,N-dimethylpropanamide
CID 54950828
3-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide
CID 106174838
N,N-dimethyl-2-(propylamino)propanamide
CID 43086179
2-hydroxy-3-[[1-oxo-1-(prop-2-enylamino)propan-2-yl]amino]propanamide
CID 106174665
2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]-N,N-dimethylpropanamide
CID 61464733
2-hydroxy-3-[[(2R)-2-hydroxypropyl]amino]propanamide
CID 106174936
ethyl 2-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]acetate
CID 60811101
2-[(2,3-dihydroxy-2-methylpropyl)amino]-N,N-dimethylpropanamide
CID 66187164
N,N-dimethyl-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]propanamide
CID 60711283

Frequently Asked Questions

What is the IUPAC name of 3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide?
The IUPAC name of 3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide (CID 106174475) is 3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide.
What is the SMILES notation for 3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide?
The canonical SMILES for 3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide is CC(NCC(O)C(N)=O)C(=O)N(C)C.
What is the InChIKey of 3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide?
The InChIKey is HVDUNWIHNIFUST-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O3/c1-5(8(14)11(2)3)10-4-6(12)7(9)13/h5-6,10,12H,4H2,1-3H3,(H2,9,13).
What are the key properties of 3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide?
3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide has a molecular weight of 203.24 g/mol, XLogP of -2.10, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide is sourced from PubChem (CID 106174475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).