1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine

C10H18N2 — CID 130775777

IUPAC1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine
SMILESNC1(CCN2CC=CC2)CCC1
InChIInChI=1S/C10H18N2/c11-10(4-3-5-10)6-9-12-7-1-2-8-12/h1-2H,3-9,11H2
InChIKeyRCPDHCIWXLSALH-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.13
Rot. Bonds3

About 1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine

1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine (PubChem CID 130775777) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine.

Molecular Properties

Compound Name1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine
PubChem CID130775777
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine
SMILESNC1(CCN2CC=CC2)CCC1
InChIInChI=1S/C10H18N2/c11-10(4-3-5-10)6-9-12-7-1-2-8-12/h1-2H,3-9,11H2
InChIKeyRCPDHCIWXLSALH-UHFFFAOYSA-N
XLogP1.13
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.13
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

1-[2-[Bis(prop-2-enyl)amino]ethyl]cyclopentan-1-amine
CID 64678499
1-[2-[Ethyl(2-methylprop-2-enyl)amino]ethyl]cyclobutan-1-amine
CID 79842499
1-[2-[Bis(prop-2-enyl)amino]ethyl]cyclobutan-1-amine
CID 79854420
1-[[Bis(prop-2-enyl)amino]methyl]cyclobutan-1-amine
CID 81168644
1-[2-[Methyl(prop-2-enyl)amino]ethyl]cyclobutan-1-amine
CID 81811266
1-[2-[Methyl(prop-2-enyl)amino]ethyl]cyclopentan-1-amine
CID 81811465
1-[2-[Ethyl(prop-2-enyl)amino]ethyl]cyclopentan-1-amine
CID 81811662
1-[2-[Prop-2-enyl(propyl)amino]ethyl]cyclobutan-1-amine
CID 81811676
1-[2-[Ethyl(prop-2-enyl)amino]ethyl]cyclobutan-1-amine
CID 81811922
1-[2-[Prop-2-enyl(propyl)amino]ethyl]cyclopentan-1-amine
CID 81811965
1-[2-[Tert-butyl(prop-2-enyl)amino]ethyl]cyclobutan-1-amine
CID 81812164
1-[2-[Cyclopropyl(prop-2-enyl)amino]ethyl]cyclobutan-1-amine
CID 81812277

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine?
The IUPAC name of 1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine (CID 130775777) is 1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine.
What is the SMILES notation for 1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine?
The canonical SMILES for 1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine is NC1(CCN2CC=CC2)CCC1.
What is the InChIKey of 1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine?
The InChIKey is RCPDHCIWXLSALH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c11-10(4-3-5-10)6-9-12-7-1-2-8-12/h1-2H,3-9,11H2.
What are the key properties of 1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine?
1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine has a molecular weight of 166.27 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,5-dihydropyrrol-1-yl)ethyl]cyclobutan-1-amine is sourced from PubChem (CID 130775777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).