1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid

C10H15NO3 — CID 8902915

IUPAC1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C10H15NO3/c12-9(7-1-2-7)11-5-3-8(4-6-11)10(13)14/h7-8H,1-6H2,(H,13,14)
InChIKeyCGVFHSAITNHPHR-UHFFFAOYSA-N
MW197.23 g/mol
LogP0.72
Rot. Bonds2

About 1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid

1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid (PubChem CID 8902915) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is 1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid
PubChem CID8902915
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C10H15NO3/c12-9(7-1-2-7)11-5-3-8(4-6-11)10(13)14/h7-8H,1-6H2,(H,13,14)
InChIKeyCGVFHSAITNHPHR-UHFFFAOYSA-N
XLogP0.72
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Acetylpiperidine-4-carboxylic acid
CID 117255
1-(Methoxycarbonyl)piperidine-4-carboxylic acid
CID 1490569
1-Formyl-4-piperidinecarboxylic Acid
CID 2759232
1-Propionyl-4-piperidinecarboxylic acid
CID 685155
4-(2-Oxopiperidin-1-Yl)Butanoic Acid
CID 12842029
1-(3-Methylbutanoyl)-4-piperidinecarboxylic acid
CID 16769238
1-(2-Methylpropanoyl)piperidine-4-carboxylic acid
CID 16770959
1-(Cyclopropylmethyl)piperidine-4-carboxylic acid hydrochloride
CID 17221488
1-Acetyl-4-methylpiperidine-4-carboxylic acid
CID 19361808
1-Methyl-2-oxopiperidine-4-carboxylic acid
CID 22265446
1-(Prop-2-ynoyl)piperidine-4-carboxylic acid
CID 24696023
1-Cyclopropylpiperidine-4-carboxylic acid hydrochloride
CID 53302045

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid?
The IUPAC name of 1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid (CID 8902915) is 1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid.
What is the SMILES notation for 1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid?
The canonical SMILES for 1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid is O=C(O)C1CCN(C(=O)C2CC2)CC1.
What is the InChIKey of 1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid?
The InChIKey is CGVFHSAITNHPHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c12-9(7-1-2-7)11-5-3-8(4-6-11)10(13)14/h7-8H,1-6H2,(H,13,14).
What are the key properties of 1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid?
1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid has a molecular weight of 197.23 g/mol, XLogP of 0.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropanecarbonyl)piperidine-4-carboxylic acid is sourced from PubChem (CID 8902915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).