2-(1-amino-3-tert-butylcyclobutyl)acetic acid

C10H19NO2 — CID 174479770

IUPAC2-(1-amino-3-tert-butylcyclobutyl)acetic acid
SMILESCC(C)(C)C1CC(N)(CC(=O)O)C1
InChIInChI=1S/C10H19NO2/c1-9(2,3)7-4-10(11,5-7)6-8(12)13/h7H,4-6,11H2,1-3H3,(H,12,13)
InChIKeyDECSIDSHQNGBHG-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.61
Rot. Bonds2

About 2-(1-amino-3-tert-butylcyclobutyl)acetic acid

2-(1-amino-3-tert-butylcyclobutyl)acetic acid (PubChem CID 174479770) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-(1-amino-3-tert-butylcyclobutyl)acetic acid.

Molecular Properties

Compound Name2-(1-amino-3-tert-butylcyclobutyl)acetic acid
PubChem CID174479770
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2-(1-amino-3-tert-butylcyclobutyl)acetic acid
SMILESCC(C)(C)C1CC(N)(CC(=O)O)C1
InChIInChI=1S/C10H19NO2/c1-9(2,3)7-4-10(11,5-7)6-8(12)13/h7H,4-6,11H2,1-3H3,(H,12,13)
InChIKeyDECSIDSHQNGBHG-UHFFFAOYSA-N
XLogP1.61
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-Amino-3-tert-butylcyclobutane-1-carboxylic acid hydrochloride
CID 138991533
3-[(1S,3R)-3-amino-2,2-dimethylcyclobutyl]propanoic acid hydrochloride
CID 165922509
1-Amino-3-propylcyclobutane-1-carboxylic acid
CID 54017977
(1-Amino-4-tert-butylcyclohexyl)acetic acid
CID 60176721
2-(2-Amino-8-fluoro-4-methyloctan-2-yl)-2-methylpropanedioic acid
CID 87532108
1-Amino-3-(4-fluoro-2,4-dimethylpentan-2-yl)cyclobutane-1-carboxylic acid
CID 124029574
1-Amino-3-(4-fluorosulfanyl-2,4-dimethylpentan-2-yl)cyclobutane-1-carboxylic acid
CID 126598691
Non-methyllysine
CID 129891688
1-Amino-3-tert-butylcyclobutane-1-carboxylic acid
CID 130742904
3-Amino-3-(3,3-difluorocyclobutyl)butanoic acid
CID 165962583
3-Amino-4,5,5-trimethylheptanoic acid
CID 11240894
3-Amino-4,5,5-trimethyloctanoic acid
CID 11241099

Frequently Asked Questions

What is the IUPAC name of 2-(1-amino-3-tert-butylcyclobutyl)acetic acid?
The IUPAC name of 2-(1-amino-3-tert-butylcyclobutyl)acetic acid (CID 174479770) is 2-(1-amino-3-tert-butylcyclobutyl)acetic acid.
What is the SMILES notation for 2-(1-amino-3-tert-butylcyclobutyl)acetic acid?
The canonical SMILES for 2-(1-amino-3-tert-butylcyclobutyl)acetic acid is CC(C)(C)C1CC(N)(CC(=O)O)C1.
What is the InChIKey of 2-(1-amino-3-tert-butylcyclobutyl)acetic acid?
The InChIKey is DECSIDSHQNGBHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-9(2,3)7-4-10(11,5-7)6-8(12)13/h7H,4-6,11H2,1-3H3,(H,12,13).
What are the key properties of 2-(1-amino-3-tert-butylcyclobutyl)acetic acid?
2-(1-amino-3-tert-butylcyclobutyl)acetic acid has a molecular weight of 185.27 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-amino-3-tert-butylcyclobutyl)acetic acid is sourced from PubChem (CID 174479770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).