2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide

C19H29N3O3 — CID 113166804

IUPAC2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide
SMILESCCCCCN(CC(=O)Nc1ccccc1N1CCOCC1)C(C)=O
InChIInChI=1S/C19H29N3O3/c1-3-4-7-10-22(16(2)23)15-19(24)20-17-8-5-6-9-18(17)21-11-13-25-14-12-21/h5-6,8-9H,3-4,7,10-15H2,1-2H3,(H,20,24)
InChIKeyBZFWVSGICLJYPV-UHFFFAOYSA-N
MW347.46 g/mol
LogP2.50
Rot. Bonds8

About 2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide

2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide (PubChem CID 113166804) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is 2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide
PubChem CID113166804
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC Name2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide
SMILESCCCCCN(CC(=O)Nc1ccccc1N1CCOCC1)C(C)=O
InChIInChI=1S/C19H29N3O3/c1-3-4-7-10-22(16(2)23)15-19(24)20-17-8-5-6-9-18(17)21-11-13-25-14-12-21/h5-6,8-9H,3-4,7,10-15H2,1-2H3,(H,20,24)
InChIKeyBZFWVSGICLJYPV-UHFFFAOYSA-N
XLogP2.50
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[acetyl(propyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 113158058
2-[acetyl(butan-2-yl)amino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 113159164
2-[acetyl(propan-2-yl)amino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 113158255
N-(2-morpholin-4-ylphenyl)-3-oxobutanamide
CID 18071535
N',N'-diethyl-N-(2-morpholin-4-ylphenyl)propanediamide
CID 108951131
2-[acetyl(cyclohexyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 113159561
3-[acetyl(3-methylbutyl)amino]-N-(2-morpholin-4-ylphenyl)propanamide
CID 113122957
2-[acetyl(pentyl)amino]-N-(2-bromophenyl)acetamide
CID 113166810
2-(N-acetyl-2,4,6-trimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 113170062
N'-butyl-N'-methyl-N-(2-morpholin-4-ylphenyl)oxamide
CID 108527465
1,2-dimethyl-3-(2-morpholin-4-ylphenyl)-1-pentylguanidine
CID 150037240
3-(N-acetyl-2-fluoroanilino)-N-(2-morpholin-4-ylphenyl)propanamide
CID 113126781

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide (CID 113166804) is 2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide is CCCCCN(CC(=O)Nc1ccccc1N1CCOCC1)C(C)=O.
What is the InChIKey of 2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide?
The InChIKey is BZFWVSGICLJYPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3/c1-3-4-7-10-22(16(2)23)15-19(24)20-17-8-5-6-9-18(17)21-11-13-25-14-12-21/h5-6,8-9H,3-4,7,10-15H2,1-2H3,(H,20,24).
What are the key properties of 2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide?
2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide has a molecular weight of 347.46 g/mol, XLogP of 2.50, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(pentyl)amino]-N-(2-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 113166804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).