N-(3-methylcyclobutyl)cyclopent-3-en-1-amine

C10H17N — CID 104859880

IUPACN-(3-methylcyclobutyl)cyclopent-3-en-1-amine
SMILESCC1CC(NC2CC=CC2)C1
InChIInChI=1S/C10H17N/c1-8-6-10(7-8)11-9-4-2-3-5-9/h2-3,8-11H,4-7H2,1H3
InChIKeyBGHOTYPLNXOZCX-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.09
Rot. Bonds2

About N-(3-methylcyclobutyl)cyclopent-3-en-1-amine

N-(3-methylcyclobutyl)cyclopent-3-en-1-amine (PubChem CID 104859880) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is N-(3-methylcyclobutyl)cyclopent-3-en-1-amine.

Molecular Properties

Compound NameN-(3-methylcyclobutyl)cyclopent-3-en-1-amine
PubChem CID104859880
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC NameN-(3-methylcyclobutyl)cyclopent-3-en-1-amine
SMILESCC1CC(NC2CC=CC2)C1
InChIInChI=1S/C10H17N/c1-8-6-10(7-8)11-9-4-2-3-5-9/h2-3,8-11H,4-7H2,1H3
InChIKeyBGHOTYPLNXOZCX-UHFFFAOYSA-N
XLogP2.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclobutyl)cyclopent-3-en-1-amine?
The IUPAC name of N-(3-methylcyclobutyl)cyclopent-3-en-1-amine (CID 104859880) is N-(3-methylcyclobutyl)cyclopent-3-en-1-amine.
What is the SMILES notation for N-(3-methylcyclobutyl)cyclopent-3-en-1-amine?
The canonical SMILES for N-(3-methylcyclobutyl)cyclopent-3-en-1-amine is CC1CC(NC2CC=CC2)C1.
What is the InChIKey of N-(3-methylcyclobutyl)cyclopent-3-en-1-amine?
The InChIKey is BGHOTYPLNXOZCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-8-6-10(7-8)11-9-4-2-3-5-9/h2-3,8-11H,4-7H2,1H3.
What are the key properties of N-(3-methylcyclobutyl)cyclopent-3-en-1-amine?
N-(3-methylcyclobutyl)cyclopent-3-en-1-amine has a molecular weight of 151.25 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclobutyl)cyclopent-3-en-1-amine is sourced from PubChem (CID 104859880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).