N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide

C9H16N2O3 — CID 18994258

IUPACN-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide
SMILESNC(=O)CNC(=O)CC1CCOCC1
InChIInChI=1S/C9H16N2O3/c10-8(12)6-11-9(13)5-7-1-3-14-4-2-7/h7H,1-6H2,(H2,10,12)(H,11,13)
InChIKeyUAIZWVZMKNQRKI-UHFFFAOYSA-N
MW200.24 g/mol
LogP-0.60
Rot. Bonds4

About N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide

N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide (PubChem CID 18994258) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide
PubChem CID18994258
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC NameN-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide
SMILESNC(=O)CNC(=O)CC1CCOCC1
InChIInChI=1S/C9H16N2O3/c10-8(12)6-11-9(13)5-7-1-3-14-4-2-7/h7H,1-6H2,(H2,10,12)(H,11,13)
InChIKeyUAIZWVZMKNQRKI-UHFFFAOYSA-N
XLogP-0.60
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide (CID 18994258) is N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide is NC(=O)CNC(=O)CC1CCOCC1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide?
The InChIKey is UAIZWVZMKNQRKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3/c10-8(12)6-11-9(13)5-7-1-3-14-4-2-7/h7H,1-6H2,(H2,10,12)(H,11,13).
What are the key properties of N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide?
N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide has a molecular weight of 200.24 g/mol, XLogP of -0.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 18994258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).