2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid

C10H19NO2 — CID 65057237

IUPAC2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid
SMILESCC(C)N(CC(=O)O)C(C)C1CC1
InChIInChI=1S/C10H19NO2/c1-7(2)11(6-10(12)13)8(3)9-4-5-9/h7-9H,4-6H2,1-3H3,(H,12,13)
InChIKeyFFLJKSRCNKUYLT-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.58
Rot. Bonds5

About 2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid

2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid (PubChem CID 65057237) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid.

Molecular Properties

Compound Name2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid
PubChem CID65057237
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid
SMILESCC(C)N(CC(=O)O)C(C)C1CC1
InChIInChI=1S/C10H19NO2/c1-7(2)11(6-10(12)13)8(3)9-4-5-9/h7-9H,4-6H2,1-3H3,(H,12,13)
InChIKeyFFLJKSRCNKUYLT-UHFFFAOYSA-N
XLogP1.58
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid?
The IUPAC name of 2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid (CID 65057237) is 2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid.
What is the SMILES notation for 2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid?
The canonical SMILES for 2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid is CC(C)N(CC(=O)O)C(C)C1CC1.
What is the InChIKey of 2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid?
The InChIKey is FFLJKSRCNKUYLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-7(2)11(6-10(12)13)8(3)9-4-5-9/h7-9H,4-6H2,1-3H3,(H,12,13).
What are the key properties of 2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid?
2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid has a molecular weight of 185.27 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid is sourced from PubChem (CID 65057237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).