2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine

C17H25ClN2O — CID 79060854

IUPAC2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
SMILESNC(Cc1ccccc1Cl)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C17H25ClN2O/c18-15-6-2-1-5-14(15)13-16(19)17(7-3-4-8-17)20-9-11-21-12-10-20/h1-2,5-6,16H,3-4,7-13,19H2
InChIKeyKEPSRUFBOZADIU-UHFFFAOYSA-N
MW308.85 g/mol
LogP2.85
Rot. Bonds4

About 2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine

2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine (PubChem CID 79060854) has the molecular formula C17H25ClN2O and a molecular weight of 308.85 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
PubChem CID79060854
Molecular FormulaC17H25ClN2O
Molecular Weight308.85 g/mol
Exact Mass308.17
IUPAC Name2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
SMILESNC(Cc1ccccc1Cl)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C17H25ClN2O/c18-15-6-2-1-5-14(15)13-16(19)17(7-3-4-8-17)20-9-11-21-12-10-20/h1-2,5-6,16H,3-4,7-13,19H2
InChIKeyKEPSRUFBOZADIU-UHFFFAOYSA-N
XLogP2.85
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.85
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine?
The IUPAC name of 2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine (CID 79060854) is 2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine.
What is the SMILES notation for 2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine?
The canonical SMILES for 2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine is NC(Cc1ccccc1Cl)C1(N2CCOCC2)CCCC1.
What is the InChIKey of 2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine?
The InChIKey is KEPSRUFBOZADIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25ClN2O/c18-15-6-2-1-5-14(15)13-16(19)17(7-3-4-8-17)20-9-11-21-12-10-20/h1-2,5-6,16H,3-4,7-13,19H2.
What are the key properties of 2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine?
2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine has a molecular weight of 308.85 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine is sourced from PubChem (CID 79060854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).