(1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine

C10H18N2O — CID 58111110

IUPAC(1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine
SMILESN[C@@H]1C=CC(CN2CCOCC2)C1
InChIInChI=1S/C10H18N2O/c11-10-2-1-9(7-10)8-12-3-5-13-6-4-12/h1-2,9-10H,3-8,11H2/t9?,10-/m1/s1
InChIKeyGNFZGGSEKSXXPZ-QVDQXJPCSA-N
MW182.27 g/mol
LogP0.22
Rot. Bonds2

About (1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine

(1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine (PubChem CID 58111110) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is (1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine.

Molecular Properties

Compound Name(1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine
PubChem CID58111110
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name(1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine
SMILESN[C@@H]1C=CC(CN2CCOCC2)C1
InChIInChI=1S/C10H18N2O/c11-10-2-1-9(7-10)8-12-3-5-13-6-4-12/h1-2,9-10H,3-8,11H2/t9?,10-/m1/s1
InChIKeyGNFZGGSEKSXXPZ-QVDQXJPCSA-N
XLogP0.22
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine?
The IUPAC name of (1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine (CID 58111110) is (1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine.
What is the SMILES notation for (1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine?
The canonical SMILES for (1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine is N[C@@H]1C=CC(CN2CCOCC2)C1.
What is the InChIKey of (1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine?
The InChIKey is GNFZGGSEKSXXPZ-QVDQXJPCSA-N. The full InChI is InChI=1S/C10H18N2O/c11-10-2-1-9(7-10)8-12-3-5-13-6-4-12/h1-2,9-10H,3-8,11H2/t9?,10-/m1/s1.
What are the key properties of (1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine?
(1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine has a molecular weight of 182.27 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine is sourced from PubChem (CID 58111110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).