2-(1-cyclopentylethylamino)butanoic acid

C11H21NO2 — CID 64667783

IUPAC2-(1-cyclopentylethylamino)butanoic acid
SMILESCCC(NC(C)C1CCCC1)C(=O)O
InChIInChI=1S/C11H21NO2/c1-3-10(11(13)14)12-8(2)9-6-4-5-7-9/h8-10,12H,3-7H2,1-2H3,(H,13,14)
InChIKeyUIXOPWGWCNXRNE-UHFFFAOYSA-N
MW199.29 g/mol
LogP2.02
Rot. Bonds5

About 2-(1-cyclopentylethylamino)butanoic acid

2-(1-cyclopentylethylamino)butanoic acid (PubChem CID 64667783) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-(1-cyclopentylethylamino)butanoic acid.

Molecular Properties

Compound Name2-(1-cyclopentylethylamino)butanoic acid
PubChem CID64667783
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-(1-cyclopentylethylamino)butanoic acid
SMILESCCC(NC(C)C1CCCC1)C(=O)O
InChIInChI=1S/C11H21NO2/c1-3-10(11(13)14)12-8(2)9-6-4-5-7-9/h8-10,12H,3-7H2,1-2H3,(H,13,14)
InChIKeyUIXOPWGWCNXRNE-UHFFFAOYSA-N
XLogP2.02
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[(1S)-1-cycloheptylethyl]amino]butanoic acid
CID 81392114
2-[[(1R)-1-cycloheptylethyl]amino]butanoic acid
CID 81392766
2-(1-cyclopentylethylamino)-3-methoxypropanoic acid
CID 103251911
methyl 2-[[(1S)-1-cycloheptylethyl]amino]butanoate
CID 115353551
2-(cyclopentylamino)butanoic acid
CID 60998249
2-(1-hydroxyethylamino)butanoic acid
CID 141327020
2-(1-cyclohexylethylamino)-N-pentan-3-ylpropanamide
CID 62405918
(2R)-2-(1-cyclopentylethylamino)butan-1-ol
CID 103922643
3-[[(1R)-1-cyclohexylethyl]amino]butanoic acid
CID 81385050
N-butan-2-yl-2-[[(1S)-1-cyclopentylethyl]amino]propanamide
CID 81396140
ethyl 2-[[(1S)-1-cyclopentylethyl]amino]propanoate
CID 81393902
2-[1-(oxan-4-yl)ethylamino]butanamide
CID 103768077

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentylethylamino)butanoic acid?
The IUPAC name of 2-(1-cyclopentylethylamino)butanoic acid (CID 64667783) is 2-(1-cyclopentylethylamino)butanoic acid.
What is the SMILES notation for 2-(1-cyclopentylethylamino)butanoic acid?
The canonical SMILES for 2-(1-cyclopentylethylamino)butanoic acid is CCC(NC(C)C1CCCC1)C(=O)O.
What is the InChIKey of 2-(1-cyclopentylethylamino)butanoic acid?
The InChIKey is UIXOPWGWCNXRNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-10(11(13)14)12-8(2)9-6-4-5-7-9/h8-10,12H,3-7H2,1-2H3,(H,13,14).
What are the key properties of 2-(1-cyclopentylethylamino)butanoic acid?
2-(1-cyclopentylethylamino)butanoic acid has a molecular weight of 199.29 g/mol, XLogP of 2.02, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentylethylamino)butanoic acid is sourced from PubChem (CID 64667783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).