N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide

C15H22N2O2 — CID 115177584

IUPACN-methyl-N-(4-propylphenyl)morpholine-3-carboxamide
SMILESCCCc1ccc(N(C)C(=O)C2COCCN2)cc1
InChIInChI=1S/C15H22N2O2/c1-3-4-12-5-7-13(8-6-12)17(2)15(18)14-11-19-10-9-16-14/h5-8,14,16H,3-4,9-11H2,1-2H3
InChIKeyXGBNIHBILTXJHB-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.59
Rot. Bonds4

About N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide

N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide (PubChem CID 115177584) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(4-propylphenyl)morpholine-3-carboxamide
PubChem CID115177584
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-methyl-N-(4-propylphenyl)morpholine-3-carboxamide
SMILESCCCc1ccc(N(C)C(=O)C2COCCN2)cc1
InChIInChI=1S/C15H22N2O2/c1-3-4-12-5-7-13(8-6-12)17(2)15(18)14-11-19-10-9-16-14/h5-8,14,16H,3-4,9-11H2,1-2H3
InChIKeyXGBNIHBILTXJHB-UHFFFAOYSA-N
XLogP1.59
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide?
The IUPAC name of N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide (CID 115177584) is N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide?
The canonical SMILES for N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide is CCCc1ccc(N(C)C(=O)C2COCCN2)cc1.
What is the InChIKey of N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide?
The InChIKey is XGBNIHBILTXJHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-4-12-5-7-13(8-6-12)17(2)15(18)14-11-19-10-9-16-14/h5-8,14,16H,3-4,9-11H2,1-2H3.
What are the key properties of N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide?
N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-propylphenyl)morpholine-3-carboxamide is sourced from PubChem (CID 115177584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).