2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid

C15H26N2O4 — CID 2429525

IUPAC2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid
SMILESO=C(O)CC1(CC(=O)NCCN2CCOCC2)CCCC1
InChIInChI=1S/C15H26N2O4/c18-13(16-5-6-17-7-9-21-10-8-17)11-15(12-14(19)20)3-1-2-4-15/h1-12H2,(H,16,18)(H,19,20)
InChIKeyMCBKHGVNFBJCRI-UHFFFAOYSA-N
MW298.38 g/mol
LogP0.86
Rot. Bonds7

About 2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid

2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid (PubChem CID 2429525) has the molecular formula C15H26N2O4 and a molecular weight of 298.38 g/mol. Its IUPAC name is 2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid
PubChem CID2429525
Molecular FormulaC15H26N2O4
Molecular Weight298.38 g/mol
Exact Mass298.19
IUPAC Name2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid
SMILESO=C(O)CC1(CC(=O)NCCN2CCOCC2)CCCC1
InChIInChI=1S/C15H26N2O4/c18-13(16-5-6-17-7-9-21-10-8-17)11-15(12-14(19)20)3-1-2-4-15/h1-12H2,(H,16,18)(H,19,20)
InChIKeyMCBKHGVNFBJCRI-UHFFFAOYSA-N
XLogP0.86
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid (CID 2429525) is 2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid is O=C(O)CC1(CC(=O)NCCN2CCOCC2)CCCC1.
What is the InChIKey of 2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid?
The InChIKey is MCBKHGVNFBJCRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O4/c18-13(16-5-6-17-7-9-21-10-8-17)11-15(12-14(19)20)3-1-2-4-15/h1-12H2,(H,16,18)(H,19,20).
What are the key properties of 2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid?
2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid has a molecular weight of 298.38 g/mol, XLogP of 0.86, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]cyclopentyl]acetic acid is sourced from PubChem (CID 2429525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).