(2R)-2-(diethylamino)propanoic acid

C7H15NO2 — CID 15115621

IUPAC(2R)-2-(diethylamino)propanoic acid
SMILESCCN(CC)[C@H](C)C(=O)O
InChIInChI=1S/C7H15NO2/c1-4-8(5-2)6(3)7(9)10/h6H,4-5H2,1-3H3,(H,9,10)/t6-/m1/s1
InChIKeyYHZCTZGJKHNVQY-ZCFIWIBFSA-N
MW145.20 g/mol
LogP0.80
Rot. Bonds4

About (2R)-2-(diethylamino)propanoic acid

(2R)-2-(diethylamino)propanoic acid (PubChem CID 15115621) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is (2R)-2-(diethylamino)propanoic acid.

Molecular Properties

Compound Name(2R)-2-(diethylamino)propanoic acid
PubChem CID15115621
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name(2R)-2-(diethylamino)propanoic acid
SMILESCCN(CC)[C@H](C)C(=O)O
InChIInChI=1S/C7H15NO2/c1-4-8(5-2)6(3)7(9)10/h6H,4-5H2,1-3H3,(H,9,10)/t6-/m1/s1
InChIKeyYHZCTZGJKHNVQY-ZCFIWIBFSA-N
XLogP0.80
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(diethylamino)propanoic acid?
The IUPAC name of (2R)-2-(diethylamino)propanoic acid (CID 15115621) is (2R)-2-(diethylamino)propanoic acid.
What is the SMILES notation for (2R)-2-(diethylamino)propanoic acid?
The canonical SMILES for (2R)-2-(diethylamino)propanoic acid is CCN(CC)[C@H](C)C(=O)O.
What is the InChIKey of (2R)-2-(diethylamino)propanoic acid?
The InChIKey is YHZCTZGJKHNVQY-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H15NO2/c1-4-8(5-2)6(3)7(9)10/h6H,4-5H2,1-3H3,(H,9,10)/t6-/m1/s1.
What are the key properties of (2R)-2-(diethylamino)propanoic acid?
(2R)-2-(diethylamino)propanoic acid has a molecular weight of 145.20 g/mol, XLogP of 0.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(diethylamino)propanoic acid is sourced from PubChem (CID 15115621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).