N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide

C8H14N2O — CID 59153919

IUPACN-(2-aminoethyl)cyclopent-3-ene-1-carboxamide
SMILESNCCNC(=O)C1CC=CC1
InChIInChI=1S/C8H14N2O/c9-5-6-10-8(11)7-3-1-2-4-7/h1-2,7H,3-6,9H2,(H,10,11)
InChIKeyHLKSALINMDSCFU-UHFFFAOYSA-N
MW154.21 g/mol
LogP0.03
Rot. Bonds3

About N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide

N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide (PubChem CID 59153919) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)cyclopent-3-ene-1-carboxamide
PubChem CID59153919
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC NameN-(2-aminoethyl)cyclopent-3-ene-1-carboxamide
SMILESNCCNC(=O)C1CC=CC1
InChIInChI=1S/C8H14N2O/c9-5-6-10-8(11)7-3-1-2-4-7/h1-2,7H,3-6,9H2,(H,10,11)
InChIKeyHLKSALINMDSCFU-UHFFFAOYSA-N
XLogP0.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
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

N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide
CID 99577743
N-(2-aminoethyl)-4,6-difluorocyclohexa-2,4-diene-1-carboxamide
CID 68305478
N-(3-amino-2,2-difluoropropyl)cyclopent-3-ene-1-carboxamide
CID 114383367
N-(1-fluoropropan-2-yl)cyclopent-3-ene-1-carboxamide
CID 131085838
N-(2,2,2-trifluoroethyl)cyclopent-3-ene-1-carboxamide
CID 131128870
N-[2-(2-methylpropanoylamino)ethyl]cyclohex-3-ene-1-carboxamide
CID 42920140
(Cyclopent-2-en-1-yl)(piperazin-1-yl)methanone
CID 21183966
1-(Cyclopent-3-ene-1-carbonyl)piperazine
CID 21184018
N-Ethyl-3-cyclopentene-1-carboxamide
CID 45084076
N-methylcyclopent-3-ene-1-carboxamide
CID 60206427
N-(2-aminoethyl)cyclohex-3-ene-1-carboxamide
CID 60964403
1-amino-N-methylcyclopent-3-ene-1-carboxamide
CID 68182525

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide?
The IUPAC name of N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide (CID 59153919) is N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide?
The canonical SMILES for N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide is NCCNC(=O)C1CC=CC1.
What is the InChIKey of N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide?
The InChIKey is HLKSALINMDSCFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c9-5-6-10-8(11)7-3-1-2-4-7/h1-2,7H,3-6,9H2,(H,10,11).
What are the key properties of N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide?
N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide has a molecular weight of 154.21 g/mol, XLogP of 0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide is sourced from PubChem (CID 59153919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).