2-butylcyclopentan-1-amine

C9H19N — CID 50987882

IUPAC2-butylcyclopentan-1-amine
SMILESCCCCC1CCCC1N
InChIInChI=1S/C9H19N/c1-2-3-5-8-6-4-7-9(8)10/h8-9H,2-7,10H2,1H3
InChIKeySKBPHDIPQLGWNR-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.30
Rot. Bonds3

About 2-butylcyclopentan-1-amine

2-butylcyclopentan-1-amine (PubChem CID 50987882) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is 2-butylcyclopentan-1-amine.

Molecular Properties

Compound Name2-butylcyclopentan-1-amine
PubChem CID50987882
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name2-butylcyclopentan-1-amine
SMILESCCCCC1CCCC1N
InChIInChI=1S/C9H19N/c1-2-3-5-8-6-4-7-9(8)10/h8-9H,2-7,10H2,1H3
InChIKeySKBPHDIPQLGWNR-UHFFFAOYSA-N
XLogP2.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-butylcyclopentan-1-amine?
The IUPAC name of 2-butylcyclopentan-1-amine (CID 50987882) is 2-butylcyclopentan-1-amine.
What is the SMILES notation for 2-butylcyclopentan-1-amine?
The canonical SMILES for 2-butylcyclopentan-1-amine is CCCCC1CCCC1N.
What is the InChIKey of 2-butylcyclopentan-1-amine?
The InChIKey is SKBPHDIPQLGWNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-2-3-5-8-6-4-7-9(8)10/h8-9H,2-7,10H2,1H3.
What are the key properties of 2-butylcyclopentan-1-amine?
2-butylcyclopentan-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butylcyclopentan-1-amine is sourced from PubChem (CID 50987882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).