3-(2-hydroxyethylamino)butanamide

C6H14N2O2 — CID 20563137

IUPAC3-(2-hydroxyethylamino)butanamide
SMILESCC(CC(N)=O)NCCO
InChIInChI=1S/C6H14N2O2/c1-5(4-6(7)10)8-2-3-9/h5,8-9H,2-4H2,1H3,(H2,7,10)
InChIKeyIVNMFAHTYFTBCN-UHFFFAOYSA-N
MW146.19 g/mol
LogP-1.17
Rot. Bonds5

About 3-(2-hydroxyethylamino)butanamide

3-(2-hydroxyethylamino)butanamide (PubChem CID 20563137) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 3-(2-hydroxyethylamino)butanamide.

Molecular Properties

Compound Name3-(2-hydroxyethylamino)butanamide
PubChem CID20563137
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Name3-(2-hydroxyethylamino)butanamide
SMILESCC(CC(N)=O)NCCO
InChIInChI=1S/C6H14N2O2/c1-5(4-6(7)10)8-2-3-9/h5,8-9H,2-4H2,1H3,(H2,7,10)
InChIKeyIVNMFAHTYFTBCN-UHFFFAOYSA-N
XLogP-1.17
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 5-1.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyethylamino)butanamide?
The IUPAC name of 3-(2-hydroxyethylamino)butanamide (CID 20563137) is 3-(2-hydroxyethylamino)butanamide.
What is the SMILES notation for 3-(2-hydroxyethylamino)butanamide?
The canonical SMILES for 3-(2-hydroxyethylamino)butanamide is CC(CC(N)=O)NCCO.
What is the InChIKey of 3-(2-hydroxyethylamino)butanamide?
The InChIKey is IVNMFAHTYFTBCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-5(4-6(7)10)8-2-3-9/h5,8-9H,2-4H2,1H3,(H2,7,10).
What are the key properties of 3-(2-hydroxyethylamino)butanamide?
3-(2-hydroxyethylamino)butanamide has a molecular weight of 146.19 g/mol, XLogP of -1.17, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyethylamino)butanamide is sourced from PubChem (CID 20563137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).