3-but-3-enyl-3-methylcyclopentan-1-amine

C10H19N — CID 116538762

IUPAC3-but-3-enyl-3-methylcyclopentan-1-amine
SMILESC=CCCC1(C)CCC(N)C1
InChIInChI=1S/C10H19N/c1-3-4-6-10(2)7-5-9(11)8-10/h3,9H,1,4-8,11H2,2H3
InChIKeyXCZSZSOZIONEHD-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.47
Rot. Bonds3

About 3-but-3-enyl-3-methylcyclopentan-1-amine

3-but-3-enyl-3-methylcyclopentan-1-amine (PubChem CID 116538762) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 3-but-3-enyl-3-methylcyclopentan-1-amine.

Molecular Properties

Compound Name3-but-3-enyl-3-methylcyclopentan-1-amine
PubChem CID116538762
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name3-but-3-enyl-3-methylcyclopentan-1-amine
SMILESC=CCCC1(C)CCC(N)C1
InChIInChI=1S/C10H19N/c1-3-4-6-10(2)7-5-9(11)8-10/h3,9H,1,4-8,11H2,2H3
InChIKeyXCZSZSOZIONEHD-UHFFFAOYSA-N
XLogP2.47
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.47
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

3-bromo-1-but-3-enyl-1-methylcyclopentane
CID 116540764
1-but-3-enyl-3-chloro-1-methylcyclopentane
CID 116540428
3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine
CID 116538737
3-chloro-1-hept-6-enyl-1-methylcyclopentane
CID 107010557
3-but-3-enyl-4,4-dimethylcyclohexan-1-amine
CID 165491861
3-methyl-3-(2-methylbutyl)cyclopentan-1-amine
CID 116538708
3-methyl-3-(oxan-4-ylmethyl)cyclopentan-1-amine
CID 116538676
3-methyl-3-propylbicyclo[4.2.0]octane
CID 148753251
3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
CID 114532157
1-but-3-enylcyclopropan-1-amine
CID 154468321
3-methyl-3-(pyridin-4-ylmethyl)cyclopentan-1-amine
CID 116538767
3-but-3-enyl-1-tert-butyl-3-methylpyrrolidine
CID 175530894

Frequently Asked Questions

What is the IUPAC name of 3-but-3-enyl-3-methylcyclopentan-1-amine?
The IUPAC name of 3-but-3-enyl-3-methylcyclopentan-1-amine (CID 116538762) is 3-but-3-enyl-3-methylcyclopentan-1-amine.
What is the SMILES notation for 3-but-3-enyl-3-methylcyclopentan-1-amine?
The canonical SMILES for 3-but-3-enyl-3-methylcyclopentan-1-amine is C=CCCC1(C)CCC(N)C1.
What is the InChIKey of 3-but-3-enyl-3-methylcyclopentan-1-amine?
The InChIKey is XCZSZSOZIONEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-3-4-6-10(2)7-5-9(11)8-10/h3,9H,1,4-8,11H2,2H3.
What are the key properties of 3-but-3-enyl-3-methylcyclopentan-1-amine?
3-but-3-enyl-3-methylcyclopentan-1-amine has a molecular weight of 153.27 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-but-3-enyl-3-methylcyclopentan-1-amine is sourced from PubChem (CID 116538762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).