2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid

C14H26N2O3 — CID 82043043

IUPAC2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid
SMILESCC1CCCC(C)N1CC(C)(C)C(=O)NCC(=O)O
InChIInChI=1S/C14H26N2O3/c1-10-6-5-7-11(2)16(10)9-14(3,4)13(19)15-8-12(17)18/h10-11H,5-9H2,1-4H3,(H,15,19)(H,17,18)
InChIKeyWPYSXLBGVNDNHJ-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.48
Rot. Bonds5

About 2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid

2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid (PubChem CID 82043043) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid
PubChem CID82043043
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid
SMILESCC1CCCC(C)N1CC(C)(C)C(=O)NCC(=O)O
InChIInChI=1S/C14H26N2O3/c1-10-6-5-7-11(2)16(10)9-14(3,4)13(19)15-8-12(17)18/h10-11H,5-9H2,1-4H3,(H,15,19)(H,17,18)
InChIKeyWPYSXLBGVNDNHJ-UHFFFAOYSA-N
XLogP1.48
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid with MolForge

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Related Compounds

2-[[2-(2,6-dimethylpiperidin-1-yl)acetyl]amino]acetic acid
CID 59404491
1-(2,6-dimethylpiperidin-1-yl)-4-(ethyl(15N)amino)-2,2,4-trimethylpentan-3-one
CID 121340865
1-(2,6-dimethylpiperidin-1-yl)-2,2,4-trimethyl-4-(propyl(15N)amino)pentan-3-one
CID 121340853
2-(cyclopropylamino)-3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-2-methylpropanoic acid
CID 104968620
2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]acetic acid
CID 6994012
2-(2,6-dimethyl(213C)azinan-1-yl)acetic acid
CID 91351477
1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-methylpropan-2-ol
CID 131140899
methyl 2-amino-3-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-methylpropanoate
CID 104968691
2-[[2-(2,2-dimethylbutanoylamino)acetyl]amino]acetic acid
CID 62677817
methyl 2-cyclopropyl-3-(2,6-dimethylpiperidin-1-yl)-2-(propan-2-ylamino)propanoate
CID 63908288
1-(2,6-dimethylpiperidin-1-yl)-N-ethyl-2-methylpropan-2-amine
CID 62834458
5-[(2S,6R)-2,6-dimethylpiperidin-1-yl]pentanoic acid
CID 28972400

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid?
The IUPAC name of 2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid (CID 82043043) is 2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid.
What is the SMILES notation for 2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid?
The canonical SMILES for 2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid is CC1CCCC(C)N1CC(C)(C)C(=O)NCC(=O)O.
What is the InChIKey of 2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid?
The InChIKey is WPYSXLBGVNDNHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-10-6-5-7-11(2)16(10)9-14(3,4)13(19)15-8-12(17)18/h10-11H,5-9H2,1-4H3,(H,15,19)(H,17,18).
What are the key properties of 2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid?
2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid has a molecular weight of 270.37 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(2,6-dimethylpiperidin-1-yl)-2,2-dimethylpropanoyl]amino]acetic acid is sourced from PubChem (CID 82043043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).