N-methyl-2-(oxolan-3-ylmethylamino)acetamide

C8H16N2O2 — CID 43310431

IUPACN-methyl-2-(oxolan-3-ylmethylamino)acetamide
SMILESCNC(=O)CNCC1CCOC1
InChIInChI=1S/C8H16N2O2/c1-9-8(11)5-10-4-7-2-3-12-6-7/h7,10H,2-6H2,1H3,(H,9,11)
InChIKeySTZWZLQLOINZQX-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.64
Rot. Bonds4

About N-methyl-2-(oxolan-3-ylmethylamino)acetamide

N-methyl-2-(oxolan-3-ylmethylamino)acetamide (PubChem CID 43310431) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is N-methyl-2-(oxolan-3-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-methyl-2-(oxolan-3-ylmethylamino)acetamide
PubChem CID43310431
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC NameN-methyl-2-(oxolan-3-ylmethylamino)acetamide
SMILESCNC(=O)CNCC1CCOC1
InChIInChI=1S/C8H16N2O2/c1-9-8(11)5-10-4-7-2-3-12-6-7/h7,10H,2-6H2,1H3,(H,9,11)
InChIKeySTZWZLQLOINZQX-UHFFFAOYSA-N
XLogP-0.64
TPSA50.36 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 ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxolan-3-ylmethylamino)acetamide?
The IUPAC name of N-methyl-2-(oxolan-3-ylmethylamino)acetamide (CID 43310431) is N-methyl-2-(oxolan-3-ylmethylamino)acetamide.
What is the SMILES notation for N-methyl-2-(oxolan-3-ylmethylamino)acetamide?
The canonical SMILES for N-methyl-2-(oxolan-3-ylmethylamino)acetamide is CNC(=O)CNCC1CCOC1.
What is the InChIKey of N-methyl-2-(oxolan-3-ylmethylamino)acetamide?
The InChIKey is STZWZLQLOINZQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-9-8(11)5-10-4-7-2-3-12-6-7/h7,10H,2-6H2,1H3,(H,9,11).
What are the key properties of N-methyl-2-(oxolan-3-ylmethylamino)acetamide?
N-methyl-2-(oxolan-3-ylmethylamino)acetamide has a molecular weight of 172.23 g/mol, XLogP of -0.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxolan-3-ylmethylamino)acetamide is sourced from PubChem (CID 43310431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).