2-(dimethylamino)-N-(hydroxymethyl)propanamide

C6H14N2O2 — CID 13328120

IUPAC2-(dimethylamino)-N-(hydroxymethyl)propanamide
SMILESCC(C(=O)NCO)N(C)C
InChIInChI=1S/C6H14N2O2/c1-5(8(2)3)6(10)7-4-9/h5,9H,4H2,1-3H3,(H,7,10)
InChIKeyAWGZEWPAFNNTCX-UHFFFAOYSA-N
MW146.19 g/mol
LogP-1.00
Rot. Bonds3

About 2-(dimethylamino)-N-(hydroxymethyl)propanamide

2-(dimethylamino)-N-(hydroxymethyl)propanamide (PubChem CID 13328120) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(hydroxymethyl)propanamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(hydroxymethyl)propanamide
PubChem CID13328120
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Name2-(dimethylamino)-N-(hydroxymethyl)propanamide
SMILESCC(C(=O)NCO)N(C)C
InChIInChI=1S/C6H14N2O2/c1-5(8(2)3)6(10)7-4-9/h5,9H,4H2,1-3H3,(H,7,10)
InChIKeyAWGZEWPAFNNTCX-UHFFFAOYSA-N
XLogP-1.00
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 5-1.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-(dimethylamino)-N-(3,4,5-trihydroxy-2-oxopentyl)propanamide
CID 156664659
2-(dimethylamino)-N-(2-oxoethyl)propanamide
CID 21254696
3-[2-(dimethylamino)propanoylamino]propanoic acid
CID 126638716
2-(dimethylamino)-N-octadecylpropanamide
CID 161206779
(2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide
CID 111840753
2,3-dihydroxy-N,N'-bis(hydroxymethyl)butanediamide
CID 5088002
2-(dimethylamino)-4-methylpentan-3-one
CID 22983306
(2S)-N-cyclopropyl-2-(dimethylamino)propanamide
CID 127013720
3-[2-[bis[2-hydroxy-3-(hydroxymethylamino)-3-oxopropyl]amino]ethyl-[2-hydroxy-3-(hydroxymethylamino)-3-oxopropyl]amino]-2-hydroxy-N-(hydroxymethyl)propanamide
CID 165341281
2,2-dichloro-N-(hydroxymethyl)acetamide
CID 12832764
2-[2-hydroxyethyl(methyl)amino]-N-(2-methylpropyl)propanamide
CID 60683962
(2S)-2-amino-N-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]-N-methylpropanamide;hydrobromide
CID 88791984

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(hydroxymethyl)propanamide?
The IUPAC name of 2-(dimethylamino)-N-(hydroxymethyl)propanamide (CID 13328120) is 2-(dimethylamino)-N-(hydroxymethyl)propanamide.
What is the SMILES notation for 2-(dimethylamino)-N-(hydroxymethyl)propanamide?
The canonical SMILES for 2-(dimethylamino)-N-(hydroxymethyl)propanamide is CC(C(=O)NCO)N(C)C.
What is the InChIKey of 2-(dimethylamino)-N-(hydroxymethyl)propanamide?
The InChIKey is AWGZEWPAFNNTCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-5(8(2)3)6(10)7-4-9/h5,9H,4H2,1-3H3,(H,7,10).
What are the key properties of 2-(dimethylamino)-N-(hydroxymethyl)propanamide?
2-(dimethylamino)-N-(hydroxymethyl)propanamide has a molecular weight of 146.19 g/mol, XLogP of -1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(hydroxymethyl)propanamide is sourced from PubChem (CID 13328120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).