2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid

C14H24N2O5 — CID 61070051

IUPAC2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid
SMILESCOCCCNC(=O)NC(=O)CC1(CC(=O)O)CCCC1
InChIInChI=1S/C14H24N2O5/c1-21-8-4-7-15-13(20)16-11(17)9-14(10-12(18)19)5-2-3-6-14/h2-10H2,1H3,(H,18,19)(H2,15,16,17,20)
InChIKeyRMXLKUAIEGWLKE-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.27
Rot. Bonds8

About 2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid

2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid (PubChem CID 61070051) has the molecular formula C14H24N2O5 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid
PubChem CID61070051
Molecular FormulaC14H24N2O5
Molecular Weight300.36 g/mol
Exact Mass300.17
IUPAC Name2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid
SMILESCOCCCNC(=O)NC(=O)CC1(CC(=O)O)CCCC1
InChIInChI=1S/C14H24N2O5/c1-21-8-4-7-15-13(20)16-11(17)9-14(10-12(18)19)5-2-3-6-14/h2-10H2,1H3,(H,18,19)(H2,15,16,17,20)
InChIKeyRMXLKUAIEGWLKE-UHFFFAOYSA-N
XLogP1.27
TPSA104.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid 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 2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid (CID 61070051) is 2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid is COCCCNC(=O)NC(=O)CC1(CC(=O)O)CCCC1.
What is the InChIKey of 2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid?
The InChIKey is RMXLKUAIEGWLKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O5/c1-21-8-4-7-15-13(20)16-11(17)9-14(10-12(18)19)5-2-3-6-14/h2-10H2,1H3,(H,18,19)(H2,15,16,17,20).
What are the key properties of 2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid?
2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid has a molecular weight of 300.36 g/mol, XLogP of 1.27, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(3-methoxypropylcarbamoylamino)-2-oxoethyl]cyclopentyl]acetic acid is sourced from PubChem (CID 61070051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).