2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid

C10H19NO3 — CID 63921124

IUPAC2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid
SMILESCC(C)(C)OCC(N)(C(=O)O)C1CC1
InChIInChI=1S/C10H19NO3/c1-9(2,3)14-6-10(11,8(12)13)7-4-5-7/h7H,4-6,11H2,1-3H3,(H,12,13)
InChIKeyYXCDEZALAVJNPU-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.99
Rot. Bonds4

About 2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid

2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid (PubChem CID 63921124) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid
PubChem CID63921124
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid
SMILESCC(C)(C)OCC(N)(C(=O)O)C1CC1
InChIInChI=1S/C10H19NO3/c1-9(2,3)14-6-10(11,8(12)13)7-4-5-7/h7H,4-6,11H2,1-3H3,(H,12,13)
InChIKeyYXCDEZALAVJNPU-UHFFFAOYSA-N
XLogP0.99
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-cyclopropyl-3-propan-2-yloxypropanoic acid
CID 63919758
2-amino-3-(cyclopentylmethoxy)-2-cyclopropylpropanoic acid
CID 66321825
2-amino-2-cyclopropyl-3-(2-cyclopropylethoxy)propanoic acid
CID 106204435
2-amino-2-cyclopropyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propanamide
CID 112589049
2-amino-2-cyclopropyl-3-(diethylamino)propanoic acid
CID 63907227
1-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 64815024
2-amino-3-(4-tert-butylpiperazin-1-yl)-2-cyclopropylpropanoic acid
CID 63909663
2-amino-2-cyclopropyl-3-(3-fluoro-4-methylphenoxy)propanoic acid
CID 107170442
2-amino-2-cyclopropyl-3-[methyl(pentyl)amino]propanoic acid
CID 63910898
3-amino-3-cyclopentyl-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid
CID 123134609
2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid
CID 63909323
2-amino-2-cyclohexyl-6,6-dimethyl-4-oxoheptanoic acid
CID 18966300

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid?
The IUPAC name of 2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid (CID 63921124) is 2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid.
What is the SMILES notation for 2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid?
The canonical SMILES for 2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid is CC(C)(C)OCC(N)(C(=O)O)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid?
The InChIKey is YXCDEZALAVJNPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-9(2,3)14-6-10(11,8(12)13)7-4-5-7/h7H,4-6,11H2,1-3H3,(H,12,13).
What are the key properties of 2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid?
2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid has a molecular weight of 201.27 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propanoic acid is sourced from PubChem (CID 63921124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).