N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide

C12H24N2O3 — CID 114032046

IUPACN-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)NCC1CCCC1CN
InChIInChI=1S/C12H24N2O3/c1-16-5-6-17-9-12(15)14-8-11-4-2-3-10(11)7-13/h10-11H,2-9,13H2,1H3,(H,14,15)
InChIKeyMHCUHUIDBHMUFG-UHFFFAOYSA-N
MW244.33 g/mol
LogP0.14
Rot. Bonds8

About N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide

N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide (PubChem CID 114032046) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide.

Molecular Properties

Compound NameN-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide
PubChem CID114032046
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC NameN-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)NCC1CCCC1CN
InChIInChI=1S/C12H24N2O3/c1-16-5-6-17-9-12(15)14-8-11-4-2-3-10(11)7-13/h10-11H,2-9,13H2,1H3,(H,14,15)
InChIKeyMHCUHUIDBHMUFG-UHFFFAOYSA-N
XLogP0.14
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[[2-(aminomethyl)cyclohexyl]methyl]-2-propoxyacetamide
CID 107941610
N-[[2-(aminomethyl)cyclohexyl]methyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 103212934
N-[[2-(chloromethyl)cyclopentyl]methyl]-2-propoxyacetamide
CID 107941206
2-(2-aminoethoxy)-N-[(2-methylcyclopropyl)methyl]acetamide
CID 115738383
N-[[2-(aminomethyl)cyclopentyl]methyl]-3-methylpentanamide
CID 114877154
3-[[2-(aminomethyl)cyclopentyl]methyl]-1,1-dimethylurea
CID 79153657
N-[(2-chlorocyclohexyl)methyl]-2-propoxyacetamide
CID 107941165
N-[[2-(chloromethyl)cyclohexyl]methyl]-2-ethoxyacetamide
CID 114307036
2-[2-[[2-(2-methoxyethoxy)acetyl]amino]ethoxy]acetamide
CID 103767893
N-ethyl-2-(2-methoxyethoxy)acetamide
CID 60651065
2-(2-aminoethoxy)-N-[3-(2-methoxyethoxy)propyl]acetamide
CID 79473525
2-(2-aminoethoxy)-N-[(1-methylpiperidin-2-yl)methyl]acetamide
CID 79478680

Frequently Asked Questions

What is the IUPAC name of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide?
The IUPAC name of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide (CID 114032046) is N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide.
What is the SMILES notation for N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide?
The canonical SMILES for N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide is COCCOCC(=O)NCC1CCCC1CN.
What is the InChIKey of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide?
The InChIKey is MHCUHUIDBHMUFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-16-5-6-17-9-12(15)14-8-11-4-2-3-10(11)7-13/h10-11H,2-9,13H2,1H3,(H,14,15).
What are the key properties of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide?
N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide has a molecular weight of 244.33 g/mol, XLogP of 0.14, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(aminomethyl)cyclopentyl]methyl]-2-(2-methoxyethoxy)acetamide is sourced from PubChem (CID 114032046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).