4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid

C10H15NO4 — CID 174923939

IUPAC4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(C2(C(=O)O)CC2)CC1
InChIInChI=1S/C10H15NO4/c12-8(13)10(3-4-10)7-1-5-11(6-2-7)9(14)15/h7H,1-6H2,(H,12,13)(H,14,15)
InChIKeyQFOARSDZYSKUOT-UHFFFAOYSA-N
MW213.23 g/mol
LogP1.24
Rot. Bonds2

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

4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid (PubChem CID 174923939) has the molecular formula C10H15NO4 and a molecular weight of 213.23 g/mol. Its IUPAC name is 4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid
PubChem CID174923939
Molecular FormulaC10H15NO4
Molecular Weight213.23 g/mol
Exact Mass213.10
IUPAC Name4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(C2(C(=O)O)CC2)CC1
InChIInChI=1S/C10H15NO4/c12-8(13)10(3-4-10)7-1-5-11(6-2-7)9(14)15/h7H,1-6H2,(H,12,13)(H,14,15)
InChIKeyQFOARSDZYSKUOT-UHFFFAOYSA-N
XLogP1.24
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.23
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid?
The IUPAC name of 4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid (CID 174923939) is 4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid.
What is the SMILES notation for 4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid?
The canonical SMILES for 4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid is O=C(O)N1CCC(C2(C(=O)O)CC2)CC1.
What is the InChIKey of 4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid?
The InChIKey is QFOARSDZYSKUOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO4/c12-8(13)10(3-4-10)7-1-5-11(6-2-7)9(14)15/h7H,1-6H2,(H,12,13)(H,14,15).
What are the key properties of 4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid?
4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid has a molecular weight of 213.23 g/mol, XLogP of 1.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-carboxycyclopropyl)piperidine-1-carboxylic acid is sourced from PubChem (CID 174923939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).