N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide

C15H22N2O2 — CID 99577743

IUPACN-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide
SMILESCN(CCNC(=O)C1CC=CC1)C(=O)C1CC=CC1
InChIInChI=1S/C15H22N2O2/c1-17(15(19)13-8-4-5-9-13)11-10-16-14(18)12-6-2-3-7-12/h2-5,12-13H,6-11H2,1H3,(H,16,18)
InChIKeyLKOALTOTZLYLNI-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.49
Rot. Bonds5

About N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide

N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide (PubChem CID 99577743) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide.

Molecular Properties

Compound NameN-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide
PubChem CID99577743
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide
SMILESCN(CCNC(=O)C1CC=CC1)C(=O)C1CC=CC1
InChIInChI=1S/C15H22N2O2/c1-17(15(19)13-8-4-5-9-13)11-10-16-14(18)12-6-2-3-7-12/h2-5,12-13H,6-11H2,1H3,(H,16,18)
InChIKeyLKOALTOTZLYLNI-UHFFFAOYSA-N
XLogP1.49
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[[(3S)-1-(cyclopent-3-ene-1-carbonyl)piperidin-3-yl]methyl]cyclopent-3-ene-1-carboxamide
CID 71853667
N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]-N-methylcyclopent-3-ene-1-carboxamide
CID 72002823
(3S)-4-(cyclopent-3-ene-1-carbonyl)-3-methylpiperazin-2-one
CID 96740616
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
tert-butyl N-[2-(cyclopent-3-ene-1-carbonylamino)ethyl]carbamate
CID 59153795
N-(2-aminoethyl)cyclopent-3-ene-1-carboxamide
CID 59153919
CID 59398774
CID 59398774
1-(Cyclopent-3-ene-1-carbonyl)imidazolidin-2-one
CID 70568651
1-[2-(2-aminoethylamino)ethyl]-3-[(E)-4-methylpent-2-enyl]pyrrolidine-2,5-dione
CID 70866012

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide?
The IUPAC name of N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide (CID 99577743) is N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide.
What is the SMILES notation for N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide?
The canonical SMILES for N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide is CN(CCNC(=O)C1CC=CC1)C(=O)C1CC=CC1.
What is the InChIKey of N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide?
The InChIKey is LKOALTOTZLYLNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-17(15(19)13-8-4-5-9-13)11-10-16-14(18)12-6-2-3-7-12/h2-5,12-13H,6-11H2,1H3,(H,16,18).
What are the key properties of N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide?
N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclopent-3-ene-1-carbonyl(methyl)amino]ethyl]cyclopent-3-ene-1-carboxamide is sourced from PubChem (CID 99577743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).