3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide

C20H25N3O2 — CID 16613280

IUPAC3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
SMILESCc1ccc(CCC(=O)Nc2ccc(N3CCOCC3)nc2)c(C)c1
InChIInChI=1S/C20H25N3O2/c1-15-3-4-17(16(2)13-15)5-8-20(24)22-18-6-7-19(21-14-18)23-9-11-25-12-10-23/h3-4,6-7,13-14H,5,8-12H2,1-2H3,(H,22,24)
InChIKeyUZKWCLCVNITDRI-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.11
Rot. Bonds5

About 3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide

3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide (PubChem CID 16613280) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide.

Molecular Properties

Compound Name3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
PubChem CID16613280
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
SMILESCc1ccc(CCC(=O)Nc2ccc(N3CCOCC3)nc2)c(C)c1
InChIInChI=1S/C20H25N3O2/c1-15-3-4-17(16(2)13-15)5-8-20(24)22-18-6-7-19(21-14-18)23-9-11-25-12-10-23/h3-4,6-7,13-14H,5,8-12H2,1-2H3,(H,22,24)
InChIKeyUZKWCLCVNITDRI-UHFFFAOYSA-N
XLogP3.11
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,5-dimethylphenoxy)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 30770544
4-[(6-morpholin-4-yl-3-pyridinyl)amino]-4-oxobutanoic acid
CID 39180266
3-(4-acetyl-5-methylfuran-2-yl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 34442879
2-(2-methoxy-4-methylphenoxy)-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 55501091
3-[(6-morpholin-4-yl-3-pyridinyl)amino]-3-oxopropanoic acid
CID 62229953
2-(3,4-dichlorophenyl)-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 17453496
2-(2,3-dihydro-1H-inden-5-yl)-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 43038081
1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 47162241
N-(6-morpholin-4-yl-3-pyridinyl)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)propanamide
CID 43041424
N-(6-morpholin-4-yl-3-pyridinyl)-3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propanamide
CID 31122725
2-(2,6-dichlorophenyl)-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 30770460
2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide
CID 18158652

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide?
The IUPAC name of 3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide (CID 16613280) is 3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide.
What is the SMILES notation for 3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide?
The canonical SMILES for 3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide is Cc1ccc(CCC(=O)Nc2ccc(N3CCOCC3)nc2)c(C)c1.
What is the InChIKey of 3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide?
The InChIKey is UZKWCLCVNITDRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-15-3-4-17(16(2)13-15)5-8-20(24)22-18-6-7-19(21-14-18)23-9-11-25-12-10-23/h3-4,6-7,13-14H,5,8-12H2,1-2H3,(H,22,24).
What are the key properties of 3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide?
3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide has a molecular weight of 339.44 g/mol, XLogP of 3.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide is sourced from PubChem (CID 16613280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).