3-propylidenecyclopentan-1-amine

C8H15N — CID 79876230

IUPAC3-propylidenecyclopentan-1-amine
SMILESCCC=C1CCC(N)C1
InChIInChI=1S/C8H15N/c1-2-3-7-4-5-8(9)6-7/h3,8H,2,4-6,9H2,1H3
InChIKeyRWUJZPSLSIWFOQ-UHFFFAOYSA-N
MW125.21 g/mol
LogP1.83
Rot. Bonds1

About 3-propylidenecyclopentan-1-amine

3-propylidenecyclopentan-1-amine (PubChem CID 79876230) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is 3-propylidenecyclopentan-1-amine.

Molecular Properties

Compound Name3-propylidenecyclopentan-1-amine
PubChem CID79876230
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name3-propylidenecyclopentan-1-amine
SMILESCCC=C1CCC(N)C1
InChIInChI=1S/C8H15N/c1-2-3-7-4-5-8(9)6-7/h3,8H,2,4-6,9H2,1H3
InChIKeyRWUJZPSLSIWFOQ-UHFFFAOYSA-N
XLogP1.83
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3Z)-1-methyl-3-propylidenecyclopentane
CID 144536317
3-pent-4-enylidenecyclopentan-1-amine
CID 79880654
(4E)-4-propylidenecyclohexane-1,2-diol
CID 68778200
(3Z)-3-hept-6-enylidenecyclopentan-1-amine
CID 107010634
bis(but-2-ene);1-methyl-3-propylidenecyclopentane
CID 173439667
4-pentylidenecyclohexan-1-amine
CID 79880726
(1S,3E)-3-propylidenecyclohexan-1-ol
CID 88974984
1-(2-bromoethyl)-4-propylidenecyclohexane
CID 18787862
2-(4-ethylcyclohexylidene)ethanamine
CID 63970724
3-(4-ethylcyclohexylidene)cyclopentan-1-amine
CID 79879182
3-(cyclopentylmethylidene)cyclopentan-1-amine
CID 79880753
2-(4-propylidenecyclohexyl)acetate
CID 18787857

Frequently Asked Questions

What is the IUPAC name of 3-propylidenecyclopentan-1-amine?
The IUPAC name of 3-propylidenecyclopentan-1-amine (CID 79876230) is 3-propylidenecyclopentan-1-amine.
What is the SMILES notation for 3-propylidenecyclopentan-1-amine?
The canonical SMILES for 3-propylidenecyclopentan-1-amine is CCC=C1CCC(N)C1.
What is the InChIKey of 3-propylidenecyclopentan-1-amine?
The InChIKey is RWUJZPSLSIWFOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-2-3-7-4-5-8(9)6-7/h3,8H,2,4-6,9H2,1H3.
What are the key properties of 3-propylidenecyclopentan-1-amine?
3-propylidenecyclopentan-1-amine has a molecular weight of 125.21 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propylidenecyclopentan-1-amine is sourced from PubChem (CID 79876230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).