N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide

C9H18N2O2 — CID 82833793

IUPACN-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide
SMILESCNC(=O)CNCC1CCC(C)O1
InChIInChI=1S/C9H18N2O2/c1-7-3-4-8(13-7)5-11-6-9(12)10-2/h7-8,11H,3-6H2,1-2H3,(H,10,12)
InChIKeyWDVNJNTUECXSOI-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.11
Rot. Bonds4

About N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide

N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide (PubChem CID 82833793) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide
PubChem CID82833793
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide
SMILESCNC(=O)CNCC1CCC(C)O1
InChIInChI=1S/C9H18N2O2/c1-7-3-4-8(13-7)5-11-6-9(12)10-2/h7-8,11H,3-6H2,1-2H3,(H,10,12)
InChIKeyWDVNJNTUECXSOI-UHFFFAOYSA-N
XLogP-0.11
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide?
The IUPAC name of N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide (CID 82833793) is N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide.
What is the SMILES notation for N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide?
The canonical SMILES for N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide is CNC(=O)CNCC1CCC(C)O1.
What is the InChIKey of N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide?
The InChIKey is WDVNJNTUECXSOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-7-3-4-8(13-7)5-11-6-9(12)10-2/h7-8,11H,3-6H2,1-2H3,(H,10,12).
What are the key properties of N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide?
N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide has a molecular weight of 186.25 g/mol, XLogP of -0.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(5-methyloxolan-2-yl)methylamino]acetamide is sourced from PubChem (CID 82833793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).