2-[piperidin-4-yl(propan-2-yl)amino]acetic acid

C10H20N2O2 — CID 22394424

IUPAC2-[piperidin-4-yl(propan-2-yl)amino]acetic acid
SMILESCC(C)N(CC(=O)O)C1CCNCC1
InChIInChI=1S/C10H20N2O2/c1-8(2)12(7-10(13)14)9-3-5-11-6-4-9/h8-9,11H,3-7H2,1-2H3,(H,13,14)
InChIKeyOYVLGUZCKPGVRB-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.53
Rot. Bonds4

About 2-[piperidin-4-yl(propan-2-yl)amino]acetic acid

2-[piperidin-4-yl(propan-2-yl)amino]acetic acid (PubChem CID 22394424) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-[piperidin-4-yl(propan-2-yl)amino]acetic acid.

Molecular Properties

Compound Name2-[piperidin-4-yl(propan-2-yl)amino]acetic acid
PubChem CID22394424
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-[piperidin-4-yl(propan-2-yl)amino]acetic acid
SMILESCC(C)N(CC(=O)O)C1CCNCC1
InChIInChI=1S/C10H20N2O2/c1-8(2)12(7-10(13)14)9-3-5-11-6-4-9/h8-9,11H,3-7H2,1-2H3,(H,13,14)
InChIKeyOYVLGUZCKPGVRB-UHFFFAOYSA-N
XLogP0.53
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[piperidin-4-yl(propan-2-yl)amino]acetic acid?
The IUPAC name of 2-[piperidin-4-yl(propan-2-yl)amino]acetic acid (CID 22394424) is 2-[piperidin-4-yl(propan-2-yl)amino]acetic acid.
What is the SMILES notation for 2-[piperidin-4-yl(propan-2-yl)amino]acetic acid?
The canonical SMILES for 2-[piperidin-4-yl(propan-2-yl)amino]acetic acid is CC(C)N(CC(=O)O)C1CCNCC1.
What is the InChIKey of 2-[piperidin-4-yl(propan-2-yl)amino]acetic acid?
The InChIKey is OYVLGUZCKPGVRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-8(2)12(7-10(13)14)9-3-5-11-6-4-9/h8-9,11H,3-7H2,1-2H3,(H,13,14).
What are the key properties of 2-[piperidin-4-yl(propan-2-yl)amino]acetic acid?
2-[piperidin-4-yl(propan-2-yl)amino]acetic acid has a molecular weight of 200.28 g/mol, XLogP of 0.53, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[piperidin-4-yl(propan-2-yl)amino]acetic acid is sourced from PubChem (CID 22394424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).