2-(2-piperidin-1-ylethylamino)propanoic acid

C10H20N2O2 — CID 43467348

IUPAC2-(2-piperidin-1-ylethylamino)propanoic acid
SMILESCC(NCCN1CCCCC1)C(=O)O
InChIInChI=1S/C10H20N2O2/c1-9(10(13)14)11-5-8-12-6-3-2-4-7-12/h9,11H,2-8H2,1H3,(H,13,14)
InChIKeyBYFXJBLXUSBSKW-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.54
Rot. Bonds5

About 2-(2-piperidin-1-ylethylamino)propanoic acid

2-(2-piperidin-1-ylethylamino)propanoic acid (PubChem CID 43467348) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-(2-piperidin-1-ylethylamino)propanoic acid.

Molecular Properties

Compound Name2-(2-piperidin-1-ylethylamino)propanoic acid
PubChem CID43467348
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-(2-piperidin-1-ylethylamino)propanoic acid
SMILESCC(NCCN1CCCCC1)C(=O)O
InChIInChI=1S/C10H20N2O2/c1-9(10(13)14)11-5-8-12-6-3-2-4-7-12/h9,11H,2-8H2,1H3,(H,13,14)
InChIKeyBYFXJBLXUSBSKW-UHFFFAOYSA-N
XLogP0.54
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-piperidin-1-ylpropylamino)propanoic acid
CID 66172280
N,N-diethyl-2-(2-piperidin-1-ylethylamino)propanamide
CID 54967472
N-[2-(azocan-1-yl)ethyl]propan-2-amine
CID 60841843
2-[3-(4-methylpiperazin-1-yl)propylamino]propanoic acid
CID 66172084
(2S)-2-[[2-(azocan-1-yl)-2-oxoethyl]amino]propanoic acid
CID 83194502
(2R)-2-[2-(2,5-dioxopyrrolidin-1-yl)ethylamino]propanoic acid
CID 83195068
N-[2-(azepan-1-yl)ethyl]-2-(propan-2-ylamino)acetamide
CID 61240012
2-(2-morpholin-4-ylethylamino)-1-piperidin-1-ylpropan-1-one
CID 43083600
1-(2-piperidin-1-ylethylamino)ethanethiol
CID 129067667
4-(2-piperidin-1-ylethylamino)pentan-1-ol
CID 115970429
2-(2-pyrrolidin-1-ylethylamino)propane-1,3-diol
CID 107911684
N-(2-pyrrolidin-1-ylethyl)butan-2-amine
CID 43181621

Frequently Asked Questions

What is the IUPAC name of 2-(2-piperidin-1-ylethylamino)propanoic acid?
The IUPAC name of 2-(2-piperidin-1-ylethylamino)propanoic acid (CID 43467348) is 2-(2-piperidin-1-ylethylamino)propanoic acid.
What is the SMILES notation for 2-(2-piperidin-1-ylethylamino)propanoic acid?
The canonical SMILES for 2-(2-piperidin-1-ylethylamino)propanoic acid is CC(NCCN1CCCCC1)C(=O)O.
What is the InChIKey of 2-(2-piperidin-1-ylethylamino)propanoic acid?
The InChIKey is BYFXJBLXUSBSKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-9(10(13)14)11-5-8-12-6-3-2-4-7-12/h9,11H,2-8H2,1H3,(H,13,14).
What are the key properties of 2-(2-piperidin-1-ylethylamino)propanoic acid?
2-(2-piperidin-1-ylethylamino)propanoic acid has a molecular weight of 200.28 g/mol, XLogP of 0.54, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-piperidin-1-ylethylamino)propanoic acid is sourced from PubChem (CID 43467348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).