N-pentan-2-ylmorpholine-4-carboxamide

C10H20N2O2 — CID 3137306

IUPACN-pentan-2-ylmorpholine-4-carboxamide
SMILESCCCC(C)NC(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O2/c1-3-4-9(2)11-10(13)12-5-7-14-8-6-12/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyWPLKUJXCYRULBR-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.22
Rot. Bonds3

About N-pentan-2-ylmorpholine-4-carboxamide

N-pentan-2-ylmorpholine-4-carboxamide (PubChem CID 3137306) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-pentan-2-ylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-pentan-2-ylmorpholine-4-carboxamide
PubChem CID3137306
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-pentan-2-ylmorpholine-4-carboxamide
SMILESCCCC(C)NC(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O2/c1-3-4-9(2)11-10(13)12-5-7-14-8-6-12/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyWPLKUJXCYRULBR-UHFFFAOYSA-N
XLogP1.22
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-pentan-2-ylmorpholine-4-carboxamide?
The IUPAC name of N-pentan-2-ylmorpholine-4-carboxamide (CID 3137306) is N-pentan-2-ylmorpholine-4-carboxamide.
What is the SMILES notation for N-pentan-2-ylmorpholine-4-carboxamide?
The canonical SMILES for N-pentan-2-ylmorpholine-4-carboxamide is CCCC(C)NC(=O)N1CCOCC1.
What is the InChIKey of N-pentan-2-ylmorpholine-4-carboxamide?
The InChIKey is WPLKUJXCYRULBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-3-4-9(2)11-10(13)12-5-7-14-8-6-12/h9H,3-8H2,1-2H3,(H,11,13).
What are the key properties of N-pentan-2-ylmorpholine-4-carboxamide?
N-pentan-2-ylmorpholine-4-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-ylmorpholine-4-carboxamide is sourced from PubChem (CID 3137306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).