2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide

C12H24N2O3 — CID 62016627

IUPAC2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(CCO)C1CCCC1
InChIInChI=1S/C12H24N2O3/c1-17-9-6-13-12(16)10-14(7-8-15)11-4-2-3-5-11/h11,15H,2-10H2,1H3,(H,13,16)
InChIKeyWTVAVANEQTXEJL-UHFFFAOYSA-N
MW244.33 g/mol
LogP-0.01
Rot. Bonds8

About 2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide

2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide (PubChem CID 62016627) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is 2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide
PubChem CID62016627
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC Name2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(CCO)C1CCCC1
InChIInChI=1S/C12H24N2O3/c1-17-9-6-13-12(16)10-14(7-8-15)11-4-2-3-5-11/h11,15H,2-10H2,1H3,(H,13,16)
InChIKeyWTVAVANEQTXEJL-UHFFFAOYSA-N
XLogP-0.01
TPSA61.80 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 ≤ 5-0.01
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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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide (CID 62016627) is 2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CN(CCO)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide?
The InChIKey is WTVAVANEQTXEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-17-9-6-13-12(16)10-14(7-8-15)11-4-2-3-5-11/h11,15H,2-10H2,1H3,(H,13,16).
What are the key properties of 2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide?
2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide has a molecular weight of 244.33 g/mol, XLogP of -0.01, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 62016627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).