N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide

C15H22N2O4 — CID 772641

IUPACN-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide
SMILESCOc1cc(NC(=O)CCN2CCOCC2)cc(OC)c1
InChIInChI=1S/C15H22N2O4/c1-19-13-9-12(10-14(11-13)20-2)16-15(18)3-4-17-5-7-21-8-6-17/h9-11H,3-8H2,1-2H3,(H,16,18)
InChIKeyRWKFXXGWLPUKLA-UHFFFAOYSA-N
MW294.35 g/mol
LogP1.36
Rot. Bonds6

About N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide

N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide (PubChem CID 772641) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide
PubChem CID772641
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC NameN-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide
SMILESCOc1cc(NC(=O)CCN2CCOCC2)cc(OC)c1
InChIInChI=1S/C15H22N2O4/c1-19-13-9-12(10-14(11-13)20-2)16-15(18)3-4-17-5-7-21-8-6-17/h9-11H,3-8H2,1-2H3,(H,16,18)
InChIKeyRWKFXXGWLPUKLA-UHFFFAOYSA-N
XLogP1.36
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide?
The IUPAC name of N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide (CID 772641) is N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide.
What is the SMILES notation for N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide?
The canonical SMILES for N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide is COc1cc(NC(=O)CCN2CCOCC2)cc(OC)c1.
What is the InChIKey of N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide?
The InChIKey is RWKFXXGWLPUKLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-19-13-9-12(10-14(11-13)20-2)16-15(18)3-4-17-5-7-21-8-6-17/h9-11H,3-8H2,1-2H3,(H,16,18).
What are the key properties of N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide?
N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide has a molecular weight of 294.35 g/mol, XLogP of 1.36, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethoxyphenyl)-3-morpholin-4-ylpropanamide is sourced from PubChem (CID 772641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).