2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide

C12H24N2O2 — CID 65051568

IUPAC2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)COC1(CN)CCC(C)C1
InChIInChI=1S/C12H24N2O2/c1-4-14(3)11(15)8-16-12(9-13)6-5-10(2)7-12/h10H,4-9,13H2,1-3H3
InChIKeyWIXKDZFFSNBWCZ-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.00
Rot. Bonds5

About 2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide

2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide (PubChem CID 65051568) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide.

Molecular Properties

Compound Name2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide
PubChem CID65051568
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)COC1(CN)CCC(C)C1
InChIInChI=1S/C12H24N2O2/c1-4-14(3)11(15)8-16-12(9-13)6-5-10(2)7-12/h10H,4-9,13H2,1-3H3
InChIKeyWIXKDZFFSNBWCZ-UHFFFAOYSA-N
XLogP1.00
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide
CID 65051629
2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-methylacetamide
CID 65051418
2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide
CID 65052460
2-[1-(aminomethyl)-3-methylcyclohexyl]oxy-N-ethylacetamide
CID 65052349
4-[1-(aminomethyl)-3-methylcyclohexyl]oxy-N,N-dimethylbutanamide
CID 65052593
[1-(3-ethylsulfonylpropoxy)-3-methylcyclopentyl]methanamine
CID 65093753
[1-(cyclobutylmethoxy)-3-methylcyclopentyl]methanamine
CID 65458688
2-[1-(aminomethyl)-4,4-dimethylcyclohexyl]oxy-N-cyclopropyl-N-methylacetamide
CID 65050897
[1-(3,3-dimethylbutoxy)-3-methylcyclopentyl]methanamine
CID 65052054
2-[1-(aminomethyl)-4-methylcyclohexyl]oxy-N-cyclopropylacetamide
CID 65050836
2-[1-(aminomethyl)cycloheptyl]oxy-N,N-dimethylacetamide
CID 65052011
2-[1-(aminomethyl)-3-methylcyclohexyl]oxy-1-morpholin-4-ylethanone
CID 65052834

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide?
The IUPAC name of 2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide (CID 65051568) is 2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide.
What is the SMILES notation for 2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide?
The canonical SMILES for 2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide is CCN(C)C(=O)COC1(CN)CCC(C)C1.
What is the InChIKey of 2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide?
The InChIKey is WIXKDZFFSNBWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-14(3)11(15)8-16-12(9-13)6-5-10(2)7-12/h10H,4-9,13H2,1-3H3.
What are the key properties of 2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide?
2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide has a molecular weight of 228.34 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide is sourced from PubChem (CID 65051568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).