2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid

C14H27NO2 — CID 83048898

IUPAC2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid
SMILESCCCC(C(=O)O)N(CC(C)C)C1CCCC1
InChIInChI=1S/C14H27NO2/c1-4-7-13(14(16)17)15(10-11(2)3)12-8-5-6-9-12/h11-13H,4-10H2,1-3H3,(H,16,17)
InChIKeyBFUNNRGKAVRAKW-UHFFFAOYSA-N
MW241.37 g/mol
LogP3.14
Rot. Bonds7

About 2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid

2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid (PubChem CID 83048898) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid.

Molecular Properties

Compound Name2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid
PubChem CID83048898
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid
SMILESCCCC(C(=O)O)N(CC(C)C)C1CCCC1
InChIInChI=1S/C14H27NO2/c1-4-7-13(14(16)17)15(10-11(2)3)12-8-5-6-9-12/h11-13H,4-10H2,1-3H3,(H,16,17)
InChIKeyBFUNNRGKAVRAKW-UHFFFAOYSA-N
XLogP3.14
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid?
The IUPAC name of 2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid (CID 83048898) is 2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid.
What is the SMILES notation for 2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid?
The canonical SMILES for 2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid is CCCC(C(=O)O)N(CC(C)C)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid?
The InChIKey is BFUNNRGKAVRAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-4-7-13(14(16)17)15(10-11(2)3)12-8-5-6-9-12/h11-13H,4-10H2,1-3H3,(H,16,17).
What are the key properties of 2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid?
2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid has a molecular weight of 241.37 g/mol, XLogP of 3.14, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid is sourced from PubChem (CID 83048898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).