N-prop-2-enylcyclopentanamine

C8H15N — CID 5062349

IUPACN-prop-2-enylcyclopentanamine
SMILESC=CCNC1CCCC1
InChIInChI=1S/C8H15N/c1-2-7-9-8-5-3-4-6-8/h2,8-9H,1,3-7H2
InChIKeyCTSIKBGUCQWRIM-UHFFFAOYSA-N
MW125.22 g/mol
LogP1.70
Rot. Bonds3

About N-prop-2-enylcyclopentanamine

N-prop-2-enylcyclopentanamine (PubChem CID 5062349) has the molecular formula C8H15N and a molecular weight of 125.22 g/mol. Its IUPAC name is N-prop-2-enylcyclopentanamine.

Molecular Properties

Compound NameN-prop-2-enylcyclopentanamine
PubChem CID5062349
Molecular FormulaC8H15N
Molecular Weight125.22 g/mol
Exact Mass125.12
IUPAC NameN-prop-2-enylcyclopentanamine
SMILESC=CCNC1CCCC1
InChIInChI=1S/C8H15N/c1-2-7-9-8-5-3-4-6-8/h2,8-9H,1,3-7H2
InChIKeyCTSIKBGUCQWRIM-UHFFFAOYSA-N
XLogP1.70
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.22
LogP ≤ 51.70
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-prop-2-enylcyclopentanamine?
The IUPAC name of N-prop-2-enylcyclopentanamine (CID 5062349) is N-prop-2-enylcyclopentanamine.
What is the SMILES notation for N-prop-2-enylcyclopentanamine?
The canonical SMILES for N-prop-2-enylcyclopentanamine is C=CCNC1CCCC1.
What is the InChIKey of N-prop-2-enylcyclopentanamine?
The InChIKey is CTSIKBGUCQWRIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-2-7-9-8-5-3-4-6-8/h2,8-9H,1,3-7H2.
What are the key properties of N-prop-2-enylcyclopentanamine?
N-prop-2-enylcyclopentanamine has a molecular weight of 125.22 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enylcyclopentanamine is sourced from PubChem (CID 5062349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).