N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide

C12H21NO3 — CID 103842228

IUPACN-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)NCCC1=CCCC1
InChIInChI=1S/C12H21NO3/c1-15-8-9-16-10-12(14)13-7-6-11-4-2-3-5-11/h4H,2-3,5-10H2,1H3,(H,13,14)
InChIKeyLYUVNUWUWPOSJV-UHFFFAOYSA-N
MW227.30 g/mol
LogP1.27
Rot. Bonds8

About N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide

N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide (PubChem CID 103842228) has the molecular formula C12H21NO3 and a molecular weight of 227.30 g/mol. Its IUPAC name is N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide.

Molecular Properties

Compound NameN-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide
PubChem CID103842228
Molecular FormulaC12H21NO3
Molecular Weight227.30 g/mol
Exact Mass227.15
IUPAC NameN-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)NCCC1=CCCC1
InChIInChI=1S/C12H21NO3/c1-15-8-9-16-10-12(14)13-7-6-11-4-2-3-5-11/h4H,2-3,5-10H2,1H3,(H,13,14)
InChIKeyLYUVNUWUWPOSJV-UHFFFAOYSA-N
XLogP1.27
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.30
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(cyclopenten-1-yl)ethyl]-2-ethoxyacetamide
CID 103842215
N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-methoxyethyl)oxamide
CID 2289204
3-bromo-N-[2-(cyclopenten-1-yl)ethyl]propanamide
CID 106173068
N-[2-(cyclopenten-1-yl)ethyl]-3-(2-methoxyethoxy)propan-1-amine
CID 106174186
methyl N-[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl]carbamate
CID 112991092
1-[2-(cyclohexen-1-yl)ethyl]-3-(5-methoxypentyl)urea
CID 122160040
N-[2-(cyclohexen-1-yl)ethyl]-2-(3,5-dimethoxyphenoxy)acetamide
CID 7713905
N-[2-(cyclohexen-1-yl)ethyl]-2-iodoacetamide
CID 64788173
1-(2-methoxyethyl)cyclopentene
CID 23262422
4-[[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl]amino]-N-(2-methoxyethyl)benzamide
CID 54835848
N-[2-(cyclohexen-1-yl)ethyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 27666325
1-[2-(cyclohexen-1-yl)ethyl]-3-ethyl-2-[4-(2-methoxyethoxy)butyl]guanidine;hydroiodide
CID 111209143

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide?
The IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide (CID 103842228) is N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide.
What is the SMILES notation for N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide?
The canonical SMILES for N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide is COCCOCC(=O)NCCC1=CCCC1.
What is the InChIKey of N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide?
The InChIKey is LYUVNUWUWPOSJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO3/c1-15-8-9-16-10-12(14)13-7-6-11-4-2-3-5-11/h4H,2-3,5-10H2,1H3,(H,13,14).
What are the key properties of N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide?
N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide has a molecular weight of 227.30 g/mol, XLogP of 1.27, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopenten-1-yl)ethyl]-2-(2-methoxyethoxy)acetamide is sourced from PubChem (CID 103842228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).