2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid

C14H26N2O3 — CID 134863040

IUPAC2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid
SMILESNCCCCCNC(=O)CC1(CC(=O)O)CCCC1
InChIInChI=1S/C14H26N2O3/c15-8-4-1-5-9-16-12(17)10-14(11-13(18)19)6-2-3-7-14/h1-11,15H2,(H,16,17)(H,18,19)
InChIKeyGDCYLIVEAJZHFD-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.66
Rot. Bonds9

About 2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid

2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid (PubChem CID 134863040) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid
PubChem CID134863040
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid
SMILESNCCCCCNC(=O)CC1(CC(=O)O)CCCC1
InChIInChI=1S/C14H26N2O3/c15-8-4-1-5-9-16-12(17)10-14(11-13(18)19)6-2-3-7-14/h1-11,15H2,(H,16,17)(H,18,19)
InChIKeyGDCYLIVEAJZHFD-UHFFFAOYSA-N
XLogP1.66
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid (CID 134863040) is 2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid is NCCCCCNC(=O)CC1(CC(=O)O)CCCC1.
What is the InChIKey of 2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid?
The InChIKey is GDCYLIVEAJZHFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c15-8-4-1-5-9-16-12(17)10-14(11-13(18)19)6-2-3-7-14/h1-11,15H2,(H,16,17)(H,18,19).
What are the key properties of 2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid?
2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid has a molecular weight of 270.37 g/mol, XLogP of 1.66, 9 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(5-aminopentylamino)-2-oxoethyl]cyclopentyl]acetic acid is sourced from PubChem (CID 134863040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).