N-(4-butan-2-ylphenyl)morpholine-4-carboxamide

C15H22N2O2 — CID 2880620

IUPACN-(4-butan-2-ylphenyl)morpholine-4-carboxamide
SMILESCCC(C)c1ccc(NC(=O)N2CCOCC2)cc1
InChIInChI=1S/C15H22N2O2/c1-3-12(2)13-4-6-14(7-5-13)16-15(18)17-8-10-19-11-9-17/h4-7,12H,3,8-11H2,1-2H3,(H,16,18)
InChIKeyMIKQUFDWYPJBFH-UHFFFAOYSA-N
MW262.35 g/mol
LogP3.06
Rot. Bonds3

About N-(4-butan-2-ylphenyl)morpholine-4-carboxamide

N-(4-butan-2-ylphenyl)morpholine-4-carboxamide (PubChem CID 2880620) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(4-butan-2-ylphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(4-butan-2-ylphenyl)morpholine-4-carboxamide
PubChem CID2880620
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(4-butan-2-ylphenyl)morpholine-4-carboxamide
SMILESCCC(C)c1ccc(NC(=O)N2CCOCC2)cc1
InChIInChI=1S/C15H22N2O2/c1-3-12(2)13-4-6-14(7-5-13)16-15(18)17-8-10-19-11-9-17/h4-7,12H,3,8-11H2,1-2H3,(H,16,18)
InChIKeyMIKQUFDWYPJBFH-UHFFFAOYSA-N
XLogP3.06
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-butan-2-ylphenyl)morpholine-4-carboxamide?
The IUPAC name of N-(4-butan-2-ylphenyl)morpholine-4-carboxamide (CID 2880620) is N-(4-butan-2-ylphenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(4-butan-2-ylphenyl)morpholine-4-carboxamide?
The canonical SMILES for N-(4-butan-2-ylphenyl)morpholine-4-carboxamide is CCC(C)c1ccc(NC(=O)N2CCOCC2)cc1.
What is the InChIKey of N-(4-butan-2-ylphenyl)morpholine-4-carboxamide?
The InChIKey is MIKQUFDWYPJBFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-12(2)13-4-6-14(7-5-13)16-15(18)17-8-10-19-11-9-17/h4-7,12H,3,8-11H2,1-2H3,(H,16,18).
What are the key properties of N-(4-butan-2-ylphenyl)morpholine-4-carboxamide?
N-(4-butan-2-ylphenyl)morpholine-4-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butan-2-ylphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 2880620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).