5-(2-cyclopentyloxybutanoylamino)pentanoic acid

C14H25NO4 — CID 119234716

IUPAC5-(2-cyclopentyloxybutanoylamino)pentanoic acid
SMILESCCC(OC1CCCC1)C(=O)NCCCCC(=O)O
InChIInChI=1S/C14H25NO4/c1-2-12(19-11-7-3-4-8-11)14(18)15-10-6-5-9-13(16)17/h11-12H,2-10H2,1H3,(H,15,18)(H,16,17)
InChIKeyIGJXCYIURZWMOF-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.10
Rot. Bonds9

About 5-(2-cyclopentyloxybutanoylamino)pentanoic acid

5-(2-cyclopentyloxybutanoylamino)pentanoic acid (PubChem CID 119234716) has the molecular formula C14H25NO4 and a molecular weight of 271.36 g/mol. Its IUPAC name is 5-(2-cyclopentyloxybutanoylamino)pentanoic acid.

Molecular Properties

Compound Name5-(2-cyclopentyloxybutanoylamino)pentanoic acid
PubChem CID119234716
Molecular FormulaC14H25NO4
Molecular Weight271.36 g/mol
Exact Mass271.18
IUPAC Name5-(2-cyclopentyloxybutanoylamino)pentanoic acid
SMILESCCC(OC1CCCC1)C(=O)NCCCCC(=O)O
InChIInChI=1S/C14H25NO4/c1-2-12(19-11-7-3-4-8-11)14(18)15-10-6-5-9-13(16)17/h11-12H,2-10H2,1H3,(H,15,18)(H,16,17)
InChIKeyIGJXCYIURZWMOF-UHFFFAOYSA-N
XLogP2.10
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-cyclohexyloxybutanoylamino)acetic acid
CID 119350338
3-[[4-(2-cyclopentyloxybutanoylamino)benzoyl]amino]propanoic acid
CID 119222959
7-(2-methylbutanoylamino)heptanoic acid
CID 24690343
6-(2,3-dimethylpentanoylamino)hexanoic acid
CID 120522549
(2R)-2-cyclopentyloxy-N-[3-(2-oxo-1-pyridinyl)propyl]butanamide
CID 96533467
2-cyclohexyloxy-N-(2-piperazin-1-ylethyl)butanamide;hydrochloride
CID 119447644
5-(cyclopentyloxyamino)pentanoic acid
CID 103262101
7-[[(2S)-2-amino-3-methylpentanoyl]amino]heptanoic acid
CID 61172355
N-(2-amino-2-phenylethyl)-2-cyclohexyloxybutanamide
CID 119528830
(2S)-2-cyclopentyloxy-N-[(1,5-dimethylpyrrol-2-yl)methyl]butanamide
CID 95625366
9-cyclohexyloxyoctadecanoic acid
CID 22371636
2-cyclohexyloxy-N-piperidin-1-ylbutanamide
CID 102560917

Frequently Asked Questions

What is the IUPAC name of 5-(2-cyclopentyloxybutanoylamino)pentanoic acid?
The IUPAC name of 5-(2-cyclopentyloxybutanoylamino)pentanoic acid (CID 119234716) is 5-(2-cyclopentyloxybutanoylamino)pentanoic acid.
What is the SMILES notation for 5-(2-cyclopentyloxybutanoylamino)pentanoic acid?
The canonical SMILES for 5-(2-cyclopentyloxybutanoylamino)pentanoic acid is CCC(OC1CCCC1)C(=O)NCCCCC(=O)O.
What is the InChIKey of 5-(2-cyclopentyloxybutanoylamino)pentanoic acid?
The InChIKey is IGJXCYIURZWMOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO4/c1-2-12(19-11-7-3-4-8-11)14(18)15-10-6-5-9-13(16)17/h11-12H,2-10H2,1H3,(H,15,18)(H,16,17).
What are the key properties of 5-(2-cyclopentyloxybutanoylamino)pentanoic acid?
5-(2-cyclopentyloxybutanoylamino)pentanoic acid has a molecular weight of 271.36 g/mol, XLogP of 2.10, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-cyclopentyloxybutanoylamino)pentanoic acid is sourced from PubChem (CID 119234716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).