4-amino-N-ethylcyclopent-2-ene-1-carboxamide

C8H14N2O — CID 79211546

IUPAC4-amino-N-ethylcyclopent-2-ene-1-carboxamide
SMILESCCNC(=O)C1C=CC(N)C1
InChIInChI=1S/C8H14N2O/c1-2-10-8(11)6-3-4-7(9)5-6/h3-4,6-7H,2,5,9H2,1H3,(H,10,11)
InChIKeyUUCPHSNMGZAMOS-UHFFFAOYSA-N
MW154.21 g/mol
LogP0.03
Rot. Bonds2

About 4-amino-N-ethylcyclopent-2-ene-1-carboxamide

4-amino-N-ethylcyclopent-2-ene-1-carboxamide (PubChem CID 79211546) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 4-amino-N-ethylcyclopent-2-ene-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-ethylcyclopent-2-ene-1-carboxamide
PubChem CID79211546
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name4-amino-N-ethylcyclopent-2-ene-1-carboxamide
SMILESCCNC(=O)C1C=CC(N)C1
InChIInChI=1S/C8H14N2O/c1-2-10-8(11)6-3-4-7(9)5-6/h3-4,6-7H,2,5,9H2,1H3,(H,10,11)
InChIKeyUUCPHSNMGZAMOS-UHFFFAOYSA-N
XLogP0.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-pentylcyclopent-2-ene-1-carboxamide
CID 79211552
4-amino-N-(2-aminoethyl)cyclopent-2-ene-1-carboxamide
CID 79207691
4-amino-N-(3-methylsulfanylpropyl)cyclopent-2-ene-1-carboxamide
CID 79207622
4-amino-N-pentan-2-ylcyclopent-2-ene-1-carboxamide
CID 79211383
4-amino-N-(2,2-difluoro-3-hydroxypropyl)cyclopent-2-ene-1-carboxamide
CID 106176733
4-amino-N-[2-(ethylamino)-2-oxoethyl]-N-methylcyclopent-2-ene-1-carboxamide
CID 79210568
3-[(4-aminocyclopent-2-ene-1-carbonyl)amino]-2-methoxypropanoic acid
CID 106109009
4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide
CID 79207720
4-amino-N-(2-methylpentan-3-yl)cyclopent-2-ene-1-carboxamide
CID 79207896
4-amino-N-[(1-methylpyrrolidin-3-yl)methyl]cyclopent-2-ene-1-carboxamide
CID 79211032
4-amino-N-ethyl-N-methylcyclopent-2-ene-1-carboxamide
CID 79211003
4-amino-N-(4-propan-2-yloxybutyl)cyclopent-2-ene-1-carboxamide
CID 114137040

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethylcyclopent-2-ene-1-carboxamide?
The IUPAC name of 4-amino-N-ethylcyclopent-2-ene-1-carboxamide (CID 79211546) is 4-amino-N-ethylcyclopent-2-ene-1-carboxamide.
What is the SMILES notation for 4-amino-N-ethylcyclopent-2-ene-1-carboxamide?
The canonical SMILES for 4-amino-N-ethylcyclopent-2-ene-1-carboxamide is CCNC(=O)C1C=CC(N)C1.
What is the InChIKey of 4-amino-N-ethylcyclopent-2-ene-1-carboxamide?
The InChIKey is UUCPHSNMGZAMOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-2-10-8(11)6-3-4-7(9)5-6/h3-4,6-7H,2,5,9H2,1H3,(H,10,11).
What are the key properties of 4-amino-N-ethylcyclopent-2-ene-1-carboxamide?
4-amino-N-ethylcyclopent-2-ene-1-carboxamide has a molecular weight of 154.21 g/mol, XLogP of 0.03, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethylcyclopent-2-ene-1-carboxamide is sourced from PubChem (CID 79211546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).