(2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid

C11H18N2O3 — CID 94424057

IUPAC(2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid
SMILESO=C(O)[C@H]1CCCCN1C(=O)NC1CCC1
InChIInChI=1S/C11H18N2O3/c14-10(15)9-6-1-2-7-13(9)11(16)12-8-4-3-5-8/h8-9H,1-7H2,(H,12,16)(H,14,15)/t9-/m1/s1
InChIKeyPYYFMSAXCJBEHE-SECBINFHSA-N
MW226.28 g/mol
LogP1.19
Rot. Bonds2

About (2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid

(2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid (PubChem CID 94424057) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is (2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid
PubChem CID94424057
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name(2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid
SMILESO=C(O)[C@H]1CCCCN1C(=O)NC1CCC1
InChIInChI=1S/C11H18N2O3/c14-10(15)9-6-1-2-7-13(9)11(16)12-8-4-3-5-8/h8-9H,1-7H2,(H,12,16)(H,14,15)/t9-/m1/s1
InChIKeyPYYFMSAXCJBEHE-SECBINFHSA-N
XLogP1.19
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-1-(cyclopentylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 78922982
1-(cyclopropylcarbamoyl)piperidine-2-carboxylic acid
CID 61187930
1-(piperidin-4-ylcarbamoyl)piperidine-2-carboxylic acid
CID 61402855
1-[(1-methylpiperidin-3-yl)carbamoyl]piperidine-2-carboxylic acid
CID 61223087
(2S)-1-[(4-hydroxycyclohexyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 61186326
(2R)-1-[(1-methylpiperidin-4-yl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 78922873
1-[(1-methylpyrrolidin-3-yl)carbamoyl]piperidine-2-carboxylic acid
CID 54950139
(2S)-1-[(1,1-dioxothian-4-yl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 61201651
1-[(1,1-dioxothian-4-yl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 61201455
1-[1-(cyclopentylcarbamoyl)piperidine-3-carbonyl]pyrrolidine-2-carboxylic acid
CID 119355521
(2S)-1-N-cyclohexyl-2-N-cyclopropylpyrrolidine-1,2-dicarboxamide
CID 1445867
(2R)-N-cyclohexyl-2-[(cyclopentanecarbonylamino)carbamoyl]pyrrolidine-1-carboxamide
CID 94790588

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid?
The IUPAC name of (2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid (CID 94424057) is (2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid.
What is the SMILES notation for (2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid?
The canonical SMILES for (2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid is O=C(O)[C@H]1CCCCN1C(=O)NC1CCC1.
What is the InChIKey of (2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid?
The InChIKey is PYYFMSAXCJBEHE-SECBINFHSA-N. The full InChI is InChI=1S/C11H18N2O3/c14-10(15)9-6-1-2-7-13(9)11(16)12-8-4-3-5-8/h8-9H,1-7H2,(H,12,16)(H,14,15)/t9-/m1/s1.
What are the key properties of (2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid?
(2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid has a molecular weight of 226.28 g/mol, XLogP of 1.19, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid is sourced from PubChem (CID 94424057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).