1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide

C10H16N2O2 — CID 142099885

IUPAC1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide
SMILESCCNC(=O)CC1(C(N)=O)CC=CC1
InChIInChI=1S/C10H16N2O2/c1-2-12-8(13)7-10(9(11)14)5-3-4-6-10/h3-4H,2,5-7H2,1H3,(H2,11,14)(H,12,13)
InChIKeyRBQNQUAFGVCWHR-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.33
Rot. Bonds4

About 1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide

1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide (PubChem CID 142099885) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide.

Molecular Properties

Compound Name1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide
PubChem CID142099885
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide
SMILESCCNC(=O)CC1(C(N)=O)CC=CC1
InChIInChI=1S/C10H16N2O2/c1-2-12-8(13)7-10(9(11)14)5-3-4-6-10/h3-4H,2,5-7H2,1H3,(H2,11,14)(H,12,13)
InChIKeyRBQNQUAFGVCWHR-UHFFFAOYSA-N
XLogP0.33
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide?
The IUPAC name of 1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide (CID 142099885) is 1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide.
What is the SMILES notation for 1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide?
The canonical SMILES for 1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide is CCNC(=O)CC1(C(N)=O)CC=CC1.
What is the InChIKey of 1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide?
The InChIKey is RBQNQUAFGVCWHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-2-12-8(13)7-10(9(11)14)5-3-4-6-10/h3-4H,2,5-7H2,1H3,(H2,11,14)(H,12,13).
What are the key properties of 1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide?
1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide has a molecular weight of 196.25 g/mol, XLogP of 0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(ethylamino)-2-oxoethyl]cyclopent-3-ene-1-carboxamide is sourced from PubChem (CID 142099885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).