N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide

C12H22N2O2 — CID 116521228

IUPACN-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide
SMILESCC1(C)CCC(CNCC(=O)NC2CC2)O1
InChIInChI=1S/C12H22N2O2/c1-12(2)6-5-10(16-12)7-13-8-11(15)14-9-3-4-9/h9-10,13H,3-8H2,1-2H3,(H,14,15)
InChIKeyKTRNKXATNLJEEQ-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.81
Rot. Bonds5

About N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide

N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide (PubChem CID 116521228) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide
PubChem CID116521228
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide
SMILESCC1(C)CCC(CNCC(=O)NC2CC2)O1
InChIInChI=1S/C12H22N2O2/c1-12(2)6-5-10(16-12)7-13-8-11(15)14-9-3-4-9/h9-10,13H,3-8H2,1-2H3,(H,14,15)
InChIKeyKTRNKXATNLJEEQ-UHFFFAOYSA-N
XLogP0.81
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(5,5-dimethyloxolan-2-yl)methylamino]cyclobutane-1-carboxylic acid
CID 116522769
N'-[(5,5-dimethyloxolan-2-yl)methyl]ethane-1,2-diamine
CID 116521389
2-(cyclopropylmethylamino)-N-(4-ethylcyclohexyl)acetamide;hydrochloride
CID 119716167
2-(1-oxaspiro[4.4]nonan-2-ylmethylamino)-N-propan-2-ylacetamide
CID 102896860
N-cyclooctyl-2-(oxolan-2-ylmethylamino)acetamide
CID 119674119
N-[(5,5-dimethyloxolan-2-yl)methyl]-2-sulfanylpropanamide
CID 164646624
N-cyclopropyl-4-(1-oxaspiro[4.5]decan-2-ylmethylamino)butanamide
CID 102897486
2-[(5,5-dimethyloxolan-2-yl)methylamino]propane-1,3-diol
CID 116521519
N-(oxan-4-yl)-2-(oxan-4-ylmethylamino)acetamide
CID 63712370
(1R)-1-cyclopentyl-N-[(5,5-dimethyloxolan-2-yl)methyl]ethanamine
CID 104889528
1-(5,5-dimethyloxolan-2-yl)-N-[(4-methyloxan-4-yl)methyl]methanamine
CID 104954515
N-cyclohexyl-2-[(1-methylcyclopropyl)methylamino]acetamide
CID 107166293

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide (CID 116521228) is N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide is CC1(C)CCC(CNCC(=O)NC2CC2)O1.
What is the InChIKey of N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide?
The InChIKey is KTRNKXATNLJEEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-12(2)6-5-10(16-12)7-13-8-11(15)14-9-3-4-9/h9-10,13H,3-8H2,1-2H3,(H,14,15).
What are the key properties of N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide?
N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide has a molecular weight of 226.32 g/mol, XLogP of 0.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide is sourced from PubChem (CID 116521228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).