6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide

C15H28N2O — CID 106175300

IUPAC6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide
SMILESCCC(CCN)CCC(=O)NCCC1=CCCC1
InChIInChI=1S/C15H28N2O/c1-2-13(9-11-16)7-8-15(18)17-12-10-14-5-3-4-6-14/h5,13H,2-4,6-12,16H2,1H3,(H,17,18)
InChIKeyCCOAJZJLAWAYNR-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.76
Rot. Bonds9

About 6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide

6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide (PubChem CID 106175300) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide.

Molecular Properties

Compound Name6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide
PubChem CID106175300
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide
SMILESCCC(CCN)CCC(=O)NCCC1=CCCC1
InChIInChI=1S/C15H28N2O/c1-2-13(9-11-16)7-8-15(18)17-12-10-14-5-3-4-6-14/h5,13H,2-4,6-12,16H2,1H3,(H,17,18)
InChIKeyCCOAJZJLAWAYNR-UHFFFAOYSA-N
XLogP2.76
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.76
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-(2-aminoethyl)-N-[2-(cyclopenten-1-yl)ethyl]-5,5-dimethylhexanamide
CID 106175448
4-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-phenylbutanamide
CID 106175165
3-bromo-N-[2-(cyclopenten-1-yl)ethyl]propanamide
CID 106173068
N-[2-(cyclopenten-1-yl)ethyl]-2-ethoxyacetamide
CID 103842215
6-amino-4-ethyl-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]hexanamide
CID 80682085
N'-[2-(cyclohexen-1-yl)ethyl]-N-heptylbutanediamide
CID 3289082
3-amino-N-[2-(cyclopenten-1-yl)ethyl]-5,5-dimethylhexanamide
CID 106175130
3-[[2-(cyclopenten-1-yl)ethylcarbamoylamino]methyl]pentanoic acid
CID 114154444
N-[2-(cyclohexen-1-yl)ethyl]-2-(3-methylbutylamino)acetamide
CID 108993945
4-amino-3-[2-(cyclopenten-1-yl)ethylamino]-N-propylbutanamide
CID 114153809
5-[2-(cyclohexen-1-yl)ethylamino]-5-oxopentanoic acid
CID 2932918
4-chloro-N-[2-(cyclohexen-1-yl)ethyl]butanamide
CID 4277806

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide?
The IUPAC name of 6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide (CID 106175300) is 6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide.
What is the SMILES notation for 6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide?
The canonical SMILES for 6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide is CCC(CCN)CCC(=O)NCCC1=CCCC1.
What is the InChIKey of 6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide?
The InChIKey is CCOAJZJLAWAYNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-2-13(9-11-16)7-8-15(18)17-12-10-14-5-3-4-6-14/h5,13H,2-4,6-12,16H2,1H3,(H,17,18).
What are the key properties of 6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide?
6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide has a molecular weight of 252.40 g/mol, XLogP of 2.76, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-ethylhexanamide is sourced from PubChem (CID 106175300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).