1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid

C11H20N2O2 — CID 83848972

IUPAC1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid
SMILESCCNC1CCN(C2CC2)CC1C(=O)O
InChIInChI=1S/C11H20N2O2/c1-2-12-10-5-6-13(8-3-4-8)7-9(10)11(14)15/h8-10,12H,2-7H2,1H3,(H,14,15)
InChIKeyGEOPQAZBPZRXTM-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.53
Rot. Bonds4

About 1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid

1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid (PubChem CID 83848972) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid.

Molecular Properties

Compound Name1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid
PubChem CID83848972
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid
SMILESCCNC1CCN(C2CC2)CC1C(=O)O
InChIInChI=1S/C11H20N2O2/c1-2-12-10-5-6-13(8-3-4-8)7-9(10)11(14)15/h8-10,12H,2-7H2,1H3,(H,14,15)
InChIKeyGEOPQAZBPZRXTM-UHFFFAOYSA-N
XLogP0.53
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S,4R)-4-acetamidopiperidine-3-carboxylic acid
CID 44270774
1-(1-Methylpiperidin-4-yl)piperidine-3-carboxylic acid
CID 3162006
1-((Propan-2-yl)carbamoyl)piperidine-3-carboxylic acid
CID 42952304
2-Methylpiperidine-3-carboxylic acid hydrochloride
CID 53407633
5,5-Dimethylpiperidine-3-carboxylic acid hydrochloride
CID 139026705
4-Aminopiperidine-3-carboxylic acid
CID 42628701
1'-Propyl-[1,4']bipiperidinyl-3-carboxylic acid
CID 3156995
2-Methylpiperidine-3-carboxylic acid
CID 13658608
4-Amino-5-fluoropiperidine-3-carboxylic acid
CID 122454033
1-(2-Aminoethyl)piperidine-3-carboxylic acid
CID 63653203
rel-(3R,4R)-4-Amino-3-piperidinecarboxylic acid
CID 102512551
(+/-)cis-4-Aminonipecotic acid
CID 129716986

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid?
The IUPAC name of 1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid (CID 83848972) is 1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid.
What is the SMILES notation for 1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid?
The canonical SMILES for 1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid is CCNC1CCN(C2CC2)CC1C(=O)O.
What is the InChIKey of 1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid?
The InChIKey is GEOPQAZBPZRXTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-2-12-10-5-6-13(8-3-4-8)7-9(10)11(14)15/h8-10,12H,2-7H2,1H3,(H,14,15).
What are the key properties of 1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid?
1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid has a molecular weight of 212.29 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 1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid is sourced from PubChem (CID 83848972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).