N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide

C12H22N2O2 — CID 43611077

IUPACN-methyl-N-(oxan-4-yl)piperidine-3-carboxamide
SMILESCN(C(=O)C1CCCNC1)C1CCOCC1
InChIInChI=1S/C12H22N2O2/c1-14(11-4-7-16-8-5-11)12(15)10-3-2-6-13-9-10/h10-11,13H,2-9H2,1H3
InChIKeyIBYOCWKOGLVLMY-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.62
Rot. Bonds2

About N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide

N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide (PubChem CID 43611077) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(oxan-4-yl)piperidine-3-carboxamide
PubChem CID43611077
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-methyl-N-(oxan-4-yl)piperidine-3-carboxamide
SMILESCN(C(=O)C1CCCNC1)C1CCOCC1
InChIInChI=1S/C12H22N2O2/c1-14(11-4-7-16-8-5-11)12(15)10-3-2-6-13-9-10/h10-11,13H,2-9H2,1H3
InChIKeyIBYOCWKOGLVLMY-UHFFFAOYSA-N
XLogP0.62
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide?
The IUPAC name of N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide (CID 43611077) is N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide?
The canonical SMILES for N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide is CN(C(=O)C1CCCNC1)C1CCOCC1.
What is the InChIKey of N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide?
The InChIKey is IBYOCWKOGLVLMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-14(11-4-7-16-8-5-11)12(15)10-3-2-6-13-9-10/h10-11,13H,2-9H2,1H3.
What are the key properties of N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide?
N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxan-4-yl)piperidine-3-carboxamide is sourced from PubChem (CID 43611077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).