1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide

C11H21N3O — CID 107390902

IUPAC1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide
SMILESNC(=O)C1CCCCN1CCC1CNC1
InChIInChI=1S/C11H21N3O/c12-11(15)10-3-1-2-5-14(10)6-4-9-7-13-8-9/h9-10,13H,1-8H2,(H2,12,15)
InChIKeyQGTFRHJWAVETSV-UHFFFAOYSA-N
MW211.31 g/mol
LogP-0.06
Rot. Bonds4

About 1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide

1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide (PubChem CID 107390902) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide
PubChem CID107390902
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide
SMILESNC(=O)C1CCCCN1CCC1CNC1
InChIInChI=1S/C11H21N3O/c12-11(15)10-3-1-2-5-14(10)6-4-9-7-13-8-9/h9-10,13H,1-8H2,(H2,12,15)
InChIKeyQGTFRHJWAVETSV-UHFFFAOYSA-N
XLogP-0.06
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide?
The IUPAC name of 1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide (CID 107390902) is 1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide.
What is the SMILES notation for 1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide?
The canonical SMILES for 1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide is NC(=O)C1CCCCN1CCC1CNC1.
What is the InChIKey of 1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide?
The InChIKey is QGTFRHJWAVETSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c12-11(15)10-3-1-2-5-14(10)6-4-9-7-13-8-9/h9-10,13H,1-8H2,(H2,12,15).
What are the key properties of 1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide?
1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide has a molecular weight of 211.31 g/mol, XLogP of -0.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(azetidin-3-yl)ethyl]piperidine-2-carboxamide is sourced from PubChem (CID 107390902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).