2-[1-cyclopropylpropyl(ethyl)amino]acetic acid

C10H19NO2 — CID 65063687

IUPAC2-[1-cyclopropylpropyl(ethyl)amino]acetic acid
SMILESCCC(C1CC1)N(CC)CC(=O)O
InChIInChI=1S/C10H19NO2/c1-3-9(8-5-6-8)11(4-2)7-10(12)13/h8-9H,3-7H2,1-2H3,(H,12,13)
InChIKeyJQEOJDDBQXHZQJ-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.58
Rot. Bonds6

About 2-[1-cyclopropylpropyl(ethyl)amino]acetic acid

2-[1-cyclopropylpropyl(ethyl)amino]acetic acid (PubChem CID 65063687) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-[1-cyclopropylpropyl(ethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[1-cyclopropylpropyl(ethyl)amino]acetic acid
PubChem CID65063687
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2-[1-cyclopropylpropyl(ethyl)amino]acetic acid
SMILESCCC(C1CC1)N(CC)CC(=O)O
InChIInChI=1S/C10H19NO2/c1-3-9(8-5-6-8)11(4-2)7-10(12)13/h8-9H,3-7H2,1-2H3,(H,12,13)
InChIKeyJQEOJDDBQXHZQJ-UHFFFAOYSA-N
XLogP1.58
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
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-cyclopropylpropyl(ethyl)amino]acetic acid?
The IUPAC name of 2-[1-cyclopropylpropyl(ethyl)amino]acetic acid (CID 65063687) is 2-[1-cyclopropylpropyl(ethyl)amino]acetic acid.
What is the SMILES notation for 2-[1-cyclopropylpropyl(ethyl)amino]acetic acid?
The canonical SMILES for 2-[1-cyclopropylpropyl(ethyl)amino]acetic acid is CCC(C1CC1)N(CC)CC(=O)O.
What is the InChIKey of 2-[1-cyclopropylpropyl(ethyl)amino]acetic acid?
The InChIKey is JQEOJDDBQXHZQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-9(8-5-6-8)11(4-2)7-10(12)13/h8-9H,3-7H2,1-2H3,(H,12,13).
What are the key properties of 2-[1-cyclopropylpropyl(ethyl)amino]acetic acid?
2-[1-cyclopropylpropyl(ethyl)amino]acetic acid has a molecular weight of 185.27 g/mol, XLogP of 1.58, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-cyclopropylpropyl(ethyl)amino]acetic acid is sourced from PubChem (CID 65063687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).