4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid

C10H20N2O2 — CID 22047993

IUPAC4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid
SMILESCC(C)N(C)C1CCN(C(=O)O)CC1
InChIInChI=1S/C10H20N2O2/c1-8(2)11(3)9-4-6-12(7-5-9)10(13)14/h8-9H,4-7H2,1-3H3,(H,13,14)
InChIKeyAJLCDNKFGHCJNL-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.47
Rot. Bonds2

About 4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid

4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid (PubChem CID 22047993) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid
PubChem CID22047993
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid
SMILESCC(C)N(C)C1CCN(C(=O)O)CC1
InChIInChI=1S/C10H20N2O2/c1-8(2)11(3)9-4-6-12(7-5-9)10(13)14/h8-9H,4-7H2,1-3H3,(H,13,14)
InChIKeyAJLCDNKFGHCJNL-UHFFFAOYSA-N
XLogP1.47
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-3-[methyl(propan-2-yl)amino]-N-propan-2-ylpyrrolidine-1-carboxamide
CID 158561695
3,3,3-trifluoro-2-hydroxy-1-[4-[methyl(propan-2-yl)amino]piperidin-1-yl]propan-1-one
CID 155262197
4-[acetyl(methyl)amino]piperidine-1-carboxylic acid
CID 68806542
4-[methyl(propan-2-yl)amino]-N-phenylpiperidine-1-carboxamide
CID 3451208
N-methyl-N-propan-2-ylcyclopropanamine
CID 21024125
2-[[1-(dimethylcarbamoyl)piperidin-4-yl]-methylamino]propanoic acid
CID 83265684
2-amino-3-methyl-1-[(3S)-3-[methyl(propan-2-yl)amino]pyrrolidin-1-yl]butan-1-one
CID 121226203
(2S)-2-amino-3-methyl-1-[3-[methyl(propan-2-yl)amino]pyrrolidin-1-yl]butan-1-one
CID 66568039
4-(1-bromoethyl)piperidine-1-carboxylic acid
CID 22936412
4-[(1S)-1-aminoethyl]piperidine-1-carboxylic acid
CID 137372946
N-(4-ethylphenyl)-4-[methyl(propan-2-yl)amino]piperidine-1-carboxamide
CID 5154545
(2S)-2-amino-1-[(3R)-3-[methyl(propan-2-yl)amino]piperidin-1-yl]propan-1-one
CID 66568007

Frequently Asked Questions

What is the IUPAC name of 4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid?
The IUPAC name of 4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid (CID 22047993) is 4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid.
What is the SMILES notation for 4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid?
The canonical SMILES for 4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid is CC(C)N(C)C1CCN(C(=O)O)CC1.
What is the InChIKey of 4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid?
The InChIKey is AJLCDNKFGHCJNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-8(2)11(3)9-4-6-12(7-5-9)10(13)14/h8-9H,4-7H2,1-3H3,(H,13,14).
What are the key properties of 4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid?
4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid has a molecular weight of 200.28 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl(propan-2-yl)amino]piperidine-1-carboxylic acid is sourced from PubChem (CID 22047993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).