3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide

C12H24N2O2 — CID 65051629

IUPAC3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide
SMILESCC1CCC(CN)(OCCC(=O)N(C)C)C1
InChIInChI=1S/C12H24N2O2/c1-10-4-6-12(8-10,9-13)16-7-5-11(15)14(2)3/h10H,4-9,13H2,1-3H3
InChIKeyJNJMBWWCDXOYBW-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.00
Rot. Bonds5

About 3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide

3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide (PubChem CID 65051629) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide
PubChem CID65051629
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide
SMILESCC1CCC(CN)(OCCC(=O)N(C)C)C1
InChIInChI=1S/C12H24N2O2/c1-10-4-6-12(8-10,9-13)16-7-5-11(15)14(2)3/h10H,4-9,13H2,1-3H3
InChIKeyJNJMBWWCDXOYBW-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

4-[1-(aminomethyl)-3-methylcyclohexyl]oxy-N,N-dimethylbutanamide
CID 65052593
2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide
CID 65051568
[1-(3,3-dimethylbutoxy)-3-methylcyclopentyl]methanamine
CID 65052054
2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-methylacetamide
CID 65051418
[1-(3-ethylsulfonylpropoxy)-3-methylcyclopentyl]methanamine
CID 65093753
[1-(cyclobutylmethoxy)-3-methylcyclopentyl]methanamine
CID 65458688
4-[1-(aminomethyl)-3-methylcyclohexyl]oxybutan-1-ol
CID 65052251
[3-methyl-1-(3-phenoxypropoxy)cyclopentyl]methanamine
CID 65051676
methyl 3-[1-(aminomethyl)-4-tert-butylcyclohexyl]oxypropanoate
CID 65052721
[1-(3-ethylsulfonylpropoxy)-3-methylcyclohexyl]methanamine
CID 65093651
[3-methyl-1-(2-pyridin-2-ylethoxy)cyclopentyl]methanamine
CID 65051527
4-[[1-(aminomethyl)-4-methylcyclohexyl]-propylamino]-N,N-dimethylbutanamide
CID 62005625

Frequently Asked Questions

What is the IUPAC name of 3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide?
The IUPAC name of 3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide (CID 65051629) is 3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide.
What is the SMILES notation for 3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide?
The canonical SMILES for 3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide is CC1CCC(CN)(OCCC(=O)N(C)C)C1.
What is the InChIKey of 3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide?
The InChIKey is JNJMBWWCDXOYBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-10-4-6-12(8-10,9-13)16-7-5-11(15)14(2)3/h10H,4-9,13H2,1-3H3.
What are the key properties of 3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide?
3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide 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 3-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N,N-dimethylpropanamide is sourced from PubChem (CID 65051629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).