2-(oxan-4-ylmethylamino)acetamide

C8H16N2O2 — CID 62386032

IUPAC2-(oxan-4-ylmethylamino)acetamide
SMILESNC(=O)CNCC1CCOCC1
InChIInChI=1S/C8H16N2O2/c9-8(11)6-10-5-7-1-3-12-4-2-7/h7,10H,1-6H2,(H2,9,11)
InChIKeyFNNZLHRROWLFBA-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.51
Rot. Bonds4

About 2-(oxan-4-ylmethylamino)acetamide

2-(oxan-4-ylmethylamino)acetamide (PubChem CID 62386032) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 2-(oxan-4-ylmethylamino)acetamide.

Molecular Properties

Compound Name2-(oxan-4-ylmethylamino)acetamide
PubChem CID62386032
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name2-(oxan-4-ylmethylamino)acetamide
SMILESNC(=O)CNCC1CCOCC1
InChIInChI=1S/C8H16N2O2/c9-8(11)6-10-5-7-1-3-12-4-2-7/h7,10H,1-6H2,(H2,9,11)
InChIKeyFNNZLHRROWLFBA-UHFFFAOYSA-N
XLogP-0.51
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(oxan-4-ylmethylamino)acetamide?
The IUPAC name of 2-(oxan-4-ylmethylamino)acetamide (CID 62386032) is 2-(oxan-4-ylmethylamino)acetamide.
What is the SMILES notation for 2-(oxan-4-ylmethylamino)acetamide?
The canonical SMILES for 2-(oxan-4-ylmethylamino)acetamide is NC(=O)CNCC1CCOCC1.
What is the InChIKey of 2-(oxan-4-ylmethylamino)acetamide?
The InChIKey is FNNZLHRROWLFBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c9-8(11)6-10-5-7-1-3-12-4-2-7/h7,10H,1-6H2,(H2,9,11).
What are the key properties of 2-(oxan-4-ylmethylamino)acetamide?
2-(oxan-4-ylmethylamino)acetamide has a molecular weight of 172.23 g/mol, XLogP of -0.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxan-4-ylmethylamino)acetamide is sourced from PubChem (CID 62386032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).