11-aminoundecanoic acid

C11H23NO2 — CID 17083

IUPAC11-aminoundecanoic acid
SMILESNCCCCCCCCCCC(=O)O
InChIInChI=1S/C11H23NO2/c12-10-8-6-4-2-1-3-5-7-9-11(13)14/h1-10,12H2,(H,13,14)
InChIKeyGUOSQNAUYHMCRU-UHFFFAOYSA-N
MW201.31 g/mol
LogP2.54
Rot. Bonds10

About 11-aminoundecanoic acid

11-aminoundecanoic acid (PubChem CID 17083) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 11-aminoundecanoic acid.

Molecular Properties

Compound Name11-aminoundecanoic acid
PubChem CID17083
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name11-aminoundecanoic acid
SMILESNCCCCCCCCCCC(=O)O
InChIInChI=1S/C11H23NO2/c12-10-8-6-4-2-1-3-5-7-9-11(13)14/h1-10,12H2,(H,13,14)
InChIKeyGUOSQNAUYHMCRU-UHFFFAOYSA-N
XLogP2.54
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-Aminohexanoic Acid
CID 564
2-Aminooctanoic acid
CID 69522
12-Aminododecanoic Acid
CID 69661
7-Aminoheptanoic acid
CID 13580
Hexamethylenediamine adipate
CID 197024
8-Aminooctanoic acid
CID 66085
(8S)-8-amino-7-oxononanoic acid
CID 448124
Decanedioic acid, compd. with 1,6-hexanediamine (1:1)
CID 165736
7,8-Diaminononanoic acid
CID 652
7-Keto-8-Aminopelargonic Acid
CID 173
(S)-2-Aminooctanedioic acid
CID 7009575
2-Aminododecanoic acid
CID 307925

Frequently Asked Questions

What is the IUPAC name of 11-aminoundecanoic acid?
The IUPAC name of 11-aminoundecanoic acid (CID 17083) is 11-aminoundecanoic acid.
What is the SMILES notation for 11-aminoundecanoic acid?
The canonical SMILES for 11-aminoundecanoic acid is NCCCCCCCCCCC(=O)O.
What is the InChIKey of 11-aminoundecanoic acid?
The InChIKey is GUOSQNAUYHMCRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c12-10-8-6-4-2-1-3-5-7-9-11(13)14/h1-10,12H2,(H,13,14).
What are the key properties of 11-aminoundecanoic acid?
11-aminoundecanoic acid has a molecular weight of 201.31 g/mol, XLogP of 2.54, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-aminoundecanoic acid is sourced from PubChem (CID 17083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).