N-[(tert-butylamino)methyl]-2-hydroxyacetamide

C7H16N2O2 — CID 14638328

IUPACN-[(tert-butylamino)methyl]-2-hydroxyacetamide
SMILESCC(C)(C)NCNC(=O)CO
InChIInChI=1S/C7H16N2O2/c1-7(2,3)9-5-8-6(11)4-10/h9-10H,4-5H2,1-3H3,(H,8,11)
InChIKeyFPDZKWRGZHFLAB-UHFFFAOYSA-N
MW160.22 g/mol
LogP-0.56
Rot. Bonds3

About N-[(tert-butylamino)methyl]-2-hydroxyacetamide

N-[(tert-butylamino)methyl]-2-hydroxyacetamide (PubChem CID 14638328) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is N-[(tert-butylamino)methyl]-2-hydroxyacetamide.

Molecular Properties

Compound NameN-[(tert-butylamino)methyl]-2-hydroxyacetamide
PubChem CID14638328
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC NameN-[(tert-butylamino)methyl]-2-hydroxyacetamide
SMILESCC(C)(C)NCNC(=O)CO
InChIInChI=1S/C7H16N2O2/c1-7(2,3)9-5-8-6(11)4-10/h9-10H,4-5H2,1-3H3,(H,8,11)
InChIKeyFPDZKWRGZHFLAB-UHFFFAOYSA-N
XLogP-0.56
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 5-0.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(tert-butylamino)methyl]-2-hydroxyacetamide?
The IUPAC name of N-[(tert-butylamino)methyl]-2-hydroxyacetamide (CID 14638328) is N-[(tert-butylamino)methyl]-2-hydroxyacetamide.
What is the SMILES notation for N-[(tert-butylamino)methyl]-2-hydroxyacetamide?
The canonical SMILES for N-[(tert-butylamino)methyl]-2-hydroxyacetamide is CC(C)(C)NCNC(=O)CO.
What is the InChIKey of N-[(tert-butylamino)methyl]-2-hydroxyacetamide?
The InChIKey is FPDZKWRGZHFLAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2/c1-7(2,3)9-5-8-6(11)4-10/h9-10H,4-5H2,1-3H3,(H,8,11).
What are the key properties of N-[(tert-butylamino)methyl]-2-hydroxyacetamide?
N-[(tert-butylamino)methyl]-2-hydroxyacetamide has a molecular weight of 160.22 g/mol, XLogP of -0.56, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(tert-butylamino)methyl]-2-hydroxyacetamide is sourced from PubChem (CID 14638328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).