2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid

C14H26N2O3 — CID 83055974

IUPAC2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid
SMILESCCCC1CCCCN1C(=O)N(CCC)CC(=O)O
InChIInChI=1S/C14H26N2O3/c1-3-7-12-8-5-6-10-16(12)14(19)15(9-4-2)11-13(17)18/h12H,3-11H2,1-2H3,(H,17,18)
InChIKeyYUPQADBBDNCFDP-UHFFFAOYSA-N
MW270.37 g/mol
LogP2.56
Rot. Bonds6

About 2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid

2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid (PubChem CID 83055974) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid
PubChem CID83055974
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid
SMILESCCCC1CCCCN1C(=O)N(CCC)CC(=O)O
InChIInChI=1S/C14H26N2O3/c1-3-7-12-8-5-6-10-16(12)14(19)15(9-4-2)11-13(17)18/h12H,3-11H2,1-2H3,(H,17,18)
InChIKeyYUPQADBBDNCFDP-UHFFFAOYSA-N
XLogP2.56
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[ethyl-(2-propylpiperidine-1-carbonyl)amino]propanoic acid
CID 83056051
3-[methyl-(2-propylpiperidine-1-carbonyl)amino]propanoic acid
CID 83055352
2-[cyclopentanecarbonyl(propyl)amino]acetic acid
CID 61011527
2-[(2-amino-2-oxoethyl)-[2-(2-hydroxyethyl)piperidine-1-carbonyl]amino]acetic acid
CID 107437737
2-[[2-(hydroxymethyl)piperidine-1-carbonyl]-(2-methylpropyl)amino]acetic acid
CID 63065796
6-oxo-6-(2-propylpiperidin-1-yl)hexanoic acid
CID 83052295
2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid
CID 61195643
3-[(2-propylpiperidine-1-carbonyl)amino]butanoic acid
CID 83055756
2-[[2-(hydroxymethyl)piperidine-1-carbonyl]-prop-2-ynylamino]acetic acid
CID 79284254
2-[1-[butyl(2-hydroxyethyl)carbamoyl]piperidin-2-yl]acetic acid
CID 61447659
2-bromo-1-(2-propylpiperidin-1-yl)ethanone
CID 83053246
2-(2-propylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 83053442

Frequently Asked Questions

What is the IUPAC name of 2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid?
The IUPAC name of 2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid (CID 83055974) is 2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid is CCCC1CCCCN1C(=O)N(CCC)CC(=O)O.
What is the InChIKey of 2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid?
The InChIKey is YUPQADBBDNCFDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-3-7-12-8-5-6-10-16(12)14(19)15(9-4-2)11-13(17)18/h12H,3-11H2,1-2H3,(H,17,18).
What are the key properties of 2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid?
2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid has a molecular weight of 270.37 g/mol, XLogP of 2.56, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid is sourced from PubChem (CID 83055974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).