2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid

C15H25NO3 — CID 43213005

IUPAC2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
SMILESCCC1CCCCN1C(=O)C1CCCCC1C(=O)O
InChIInChI=1S/C15H25NO3/c1-2-11-7-5-6-10-16(11)14(17)12-8-3-4-9-13(12)15(18)19/h11-13H,2-10H2,1H3,(H,18,19)
InChIKeyVCHFELHGMLEDKM-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.67
Rot. Bonds3

About 2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid

2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid (PubChem CID 43213005) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
PubChem CID43213005
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
SMILESCCC1CCCCN1C(=O)C1CCCCC1C(=O)O
InChIInChI=1S/C15H25NO3/c1-2-11-7-5-6-10-16(11)14(17)12-8-3-4-9-13(12)15(18)19/h11-13H,2-10H2,1H3,(H,18,19)
InChIKeyVCHFELHGMLEDKM-UHFFFAOYSA-N
XLogP2.67
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-propylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 83053442
2-[2-(hydroxymethyl)azepane-1-carbonyl]cyclohexane-1-carboxylic acid
CID 116634329
4-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 63783975
(2-ethylpyrrolidin-1-yl)-[(1S,2S)-2-methylcyclopropyl]methanone
CID 130685547
cyclohexyl-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 798108
4-(2-ethylpyrrolidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 63782284
[2-(2-ethylpiperidine-1-carbonyl)cyclopropyl]-(4-methylpiperidin-1-yl)methanone
CID 109132625
[(2R)-2-ethylpiperidin-1-yl]-[(1S,2R)-2-phenylcyclopropyl]methanone
CID 124714524
4-ethyl-2-[2-(hydroxymethyl)piperidine-1-carbonyl]cyclopentane-1-carboxylic acid
CID 114511445
(5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone
CID 55116507
2-(2-methylpiperidine-1-carbonyl)cyclobutane-1-carboxylic acid
CID 120974339
[4-[(2S)-2-ethylpiperidine-1-carbonyl]phenyl]-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 1087323

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid?
The IUPAC name of 2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid (CID 43213005) is 2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid.
What is the SMILES notation for 2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid?
The canonical SMILES for 2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid is CCC1CCCCN1C(=O)C1CCCCC1C(=O)O.
What is the InChIKey of 2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid?
The InChIKey is VCHFELHGMLEDKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-2-11-7-5-6-10-16(11)14(17)12-8-3-4-9-13(12)15(18)19/h11-13H,2-10H2,1H3,(H,18,19).
What are the key properties of 2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid?
2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid has a molecular weight of 267.37 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid is sourced from PubChem (CID 43213005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).