2-[tert-butyl(cyclopentyl)amino]acetic acid

C11H21NO2 — CID 79268396

IUPAC2-[tert-butyl(cyclopentyl)amino]acetic acid
SMILESCC(C)(C)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C11H21NO2/c1-11(2,3)12(8-10(13)14)9-6-4-5-7-9/h9H,4-8H2,1-3H3,(H,13,14)
InChIKeyHIOLQXBNOFUZMP-UHFFFAOYSA-N
MW199.29 g/mol
LogP2.11
Rot. Bonds3

About 2-[tert-butyl(cyclopentyl)amino]acetic acid

2-[tert-butyl(cyclopentyl)amino]acetic acid (PubChem CID 79268396) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-[tert-butyl(cyclopentyl)amino]acetic acid.

Molecular Properties

Compound Name2-[tert-butyl(cyclopentyl)amino]acetic acid
PubChem CID79268396
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-[tert-butyl(cyclopentyl)amino]acetic acid
SMILESCC(C)(C)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C11H21NO2/c1-11(2,3)12(8-10(13)14)9-6-4-5-7-9/h9H,4-8H2,1-3H3,(H,13,14)
InChIKeyHIOLQXBNOFUZMP-UHFFFAOYSA-N
XLogP2.11
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[tert-butyl-(1,1-dioxothian-4-yl)amino]acetic acid
CID 79269055
2-[tert-butyl(thian-3-yl)amino]acetic acid
CID 79269334
2-[tert-butyl-[cyclopentyl(methyl)carbamoyl]amino]acetic acid
CID 79256990
2-[cycloheptyl(methyl)amino]acetic acid
CID 43409736
2-[tert-butyl-(2-ethyloxan-4-yl)amino]acetic acid
CID 79268341
2-[cyclooctyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]acetic acid
CID 22476048
2-[cyclopentyl(2-methylbutan-2-ylcarbamoyl)amino]acetic acid
CID 61188941
2-[cyclohexyl(deuteriomethyl)amino]acetic acid
CID 176582981
2-[(2-amino-2-phenylpropanoyl)-cyclopentylamino]acetic acid
CID 62488951
2-[cyclopentyl(2-methylpropyl)amino]acetic acid
CID 60835237
2-[cyclododecyl(propyl)amino]acetic acid
CID 65064979
2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid
CID 61342644

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(cyclopentyl)amino]acetic acid?
The IUPAC name of 2-[tert-butyl(cyclopentyl)amino]acetic acid (CID 79268396) is 2-[tert-butyl(cyclopentyl)amino]acetic acid.
What is the SMILES notation for 2-[tert-butyl(cyclopentyl)amino]acetic acid?
The canonical SMILES for 2-[tert-butyl(cyclopentyl)amino]acetic acid is CC(C)(C)N(CC(=O)O)C1CCCC1.
What is the InChIKey of 2-[tert-butyl(cyclopentyl)amino]acetic acid?
The InChIKey is HIOLQXBNOFUZMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-11(2,3)12(8-10(13)14)9-6-4-5-7-9/h9H,4-8H2,1-3H3,(H,13,14).
What are the key properties of 2-[tert-butyl(cyclopentyl)amino]acetic acid?
2-[tert-butyl(cyclopentyl)amino]acetic acid has a molecular weight of 199.29 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(cyclopentyl)amino]acetic acid is sourced from PubChem (CID 79268396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).