4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide

C11H20N2O2 — CID 79207135

IUPAC4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide
SMILESCCOCC(C)NC(=O)C1C=CC(N)C1
InChIInChI=1S/C11H20N2O2/c1-3-15-7-8(2)13-11(14)9-4-5-10(12)6-9/h4-5,8-10H,3,6-7,12H2,1-2H3,(H,13,14)
InChIKeyCQIRCWXMSAMNSA-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.43
Rot. Bonds5

About 4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide

4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide (PubChem CID 79207135) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide
PubChem CID79207135
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide
SMILESCCOCC(C)NC(=O)C1C=CC(N)C1
InChIInChI=1S/C11H20N2O2/c1-3-15-7-8(2)13-11(14)9-4-5-10(12)6-9/h4-5,8-10H,3,6-7,12H2,1-2H3,(H,13,14)
InChIKeyCQIRCWXMSAMNSA-UHFFFAOYSA-N
XLogP0.43
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-acetyl-5-(2-methylpropyl)-N-(2-morpholin-4-ylethyl)-2H-pyrrole-5-carboxamide
CID 5459650
4-amino-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopent-2-ene-1-carboxamide
CID 79208300
4-amino-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)cyclopent-2-ene-1-carboxamide
CID 79211046
4-amino-N-[2-(2,2-difluoroethoxy)ethyl]cyclopent-2-ene-1-carboxamide
CID 105909961
1-acetyl-N-(2-methoxyethyl)-5-(2-methylpropyl)-2H-pyrrole-5-carboxamide
CID 5459646
(Z)-N-[2-(2-aminoethoxy)ethyl]oct-5-enamide
CID 168852504
2-cyclopent-2-en-1-yl-N-(3-methyl-2-morpholin-4-ylbutyl)acetamide
CID 60371211
2-cyclopent-2-en-1-yl-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 60371329
Ethyl 2-[(2-cyclopent-2-en-1-ylacetyl)amino]propanoate
CID 61344415
(4-Aminocyclopent-2-en-1-yl)-(4-ethoxypiperidin-1-yl)methanone
CID 79207024
4-amino-N-(4-methoxybutyl)cyclopent-2-ene-1-carboxamide
CID 79207038
4-amino-N-[2-[2-methoxyethyl(methyl)amino]ethyl]cyclopent-2-ene-1-carboxamide
CID 79207046

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide?
The IUPAC name of 4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide (CID 79207135) is 4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide.
What is the SMILES notation for 4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide?
The canonical SMILES for 4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide is CCOCC(C)NC(=O)C1C=CC(N)C1.
What is the InChIKey of 4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide?
The InChIKey is CQIRCWXMSAMNSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-3-15-7-8(2)13-11(14)9-4-5-10(12)6-9/h4-5,8-10H,3,6-7,12H2,1-2H3,(H,13,14).
What are the key properties of 4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide?
4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide has a molecular weight of 212.29 g/mol, XLogP of 0.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-ethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide is sourced from PubChem (CID 79207135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).