3-pentylcyclopent-2-en-1-amine

C10H19N — CID 65174875

IUPAC3-pentylcyclopent-2-en-1-amine
SMILESCCCCCC1=CC(N)CC1
InChIInChI=1S/C10H19N/c1-2-3-4-5-9-6-7-10(11)8-9/h8,10H,2-7,11H2,1H3
InChIKeyFAFIFNOIYHVPIR-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.61
Rot. Bonds4

About 3-pentylcyclopent-2-en-1-amine

3-pentylcyclopent-2-en-1-amine (PubChem CID 65174875) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 3-pentylcyclopent-2-en-1-amine.

Molecular Properties

Compound Name3-pentylcyclopent-2-en-1-amine
PubChem CID65174875
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name3-pentylcyclopent-2-en-1-amine
SMILESCCCCCC1=CC(N)CC1
InChIInChI=1S/C10H19N/c1-2-3-4-5-9-6-7-10(11)8-9/h8,10H,2-7,11H2,1H3
InChIKeyFAFIFNOIYHVPIR-UHFFFAOYSA-N
XLogP2.61
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-dodecylcyclopent-2-en-1-amine
CID 65174520
3-decylcyclopent-2-en-1-amine
CID 65174759
3-butylcyclopent-2-en-1-ol
CID 65174589
3-(2-methylsulfinylethyl)cyclopent-2-en-1-amine
CID 130791836
3-chloro-1-octylcycloheptene
CID 107383725
1-pentylcyclopropene
CID 159067584
(3-butylcyclopent-2-en-1-yl)benzene
CID 13199080
1-hexylcyclobutene
CID 86205685
3-(2-propylsulfonylethyl)cyclohept-2-en-1-amine
CID 107383292
(3-hexylcyclohex-2-en-1-yl)benzene
CID 100958783
3-(2-phenylsulfanylethyl)cyclopent-2-en-1-amine
CID 79224577
1-tridecylcyclopropene
CID 22621692

Frequently Asked Questions

What is the IUPAC name of 3-pentylcyclopent-2-en-1-amine?
The IUPAC name of 3-pentylcyclopent-2-en-1-amine (CID 65174875) is 3-pentylcyclopent-2-en-1-amine.
What is the SMILES notation for 3-pentylcyclopent-2-en-1-amine?
The canonical SMILES for 3-pentylcyclopent-2-en-1-amine is CCCCCC1=CC(N)CC1.
What is the InChIKey of 3-pentylcyclopent-2-en-1-amine?
The InChIKey is FAFIFNOIYHVPIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-2-3-4-5-9-6-7-10(11)8-9/h8,10H,2-7,11H2,1H3.
What are the key properties of 3-pentylcyclopent-2-en-1-amine?
3-pentylcyclopent-2-en-1-amine has a molecular weight of 153.27 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pentylcyclopent-2-en-1-amine is sourced from PubChem (CID 65174875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).