2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide

C18H30N4O2 — CID 108994999

IUPAC2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide
SMILESCCN(CC)c1ccc(NCC(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C18H30N4O2/c1-3-22(4-2)17-7-5-16(6-8-17)20-15-18(23)19-9-10-21-11-13-24-14-12-21/h5-8,20H,3-4,9-15H2,1-2H3,(H,19,23)
InChIKeyRKFWGLOANQFZES-UHFFFAOYSA-N
MW334.46 g/mol
LogP1.39
Rot. Bonds9

About 2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide

2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 108994999) has the molecular formula C18H30N4O2 and a molecular weight of 334.46 g/mol. Its IUPAC name is 2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID108994999
Molecular FormulaC18H30N4O2
Molecular Weight334.46 g/mol
Exact Mass334.24
IUPAC Name2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide
SMILESCCN(CC)c1ccc(NCC(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C18H30N4O2/c1-3-22(4-2)17-7-5-16(6-8-17)20-15-18(23)19-9-10-21-11-13-24-14-12-21/h5-8,20H,3-4,9-15H2,1-2H3,(H,19,23)
InChIKeyRKFWGLOANQFZES-UHFFFAOYSA-N
XLogP1.39
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-[4-(diethylamino)phenyl]-3-(2-morpholin-4-ylethylamino)propanamide
CID 109016821
N-(2-morpholin-4-ylethyl)-2-(4-phenoxyanilino)acetamide
CID 108995006
(Z)-2-cyano-3-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)prop-2-enamide
CID 108863132
3-(4-methylanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109016587
2-(diethylcarbamoylamino)-N-(2-morpholin-4-ylethyl)acetamide
CID 110285196
2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide
CID 109010373
4-(ethylamino)-N-(2-morpholin-4-ylethyl)benzamide
CID 62166054
3-(4-fluoroanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109016608
2-(2-methoxyanilino)-N-(2-morpholin-4-ylethyl)acetamide
CID 108994975
N'-ethyl-N-(2-morpholin-4-ylethyl)-N'-phenylpropanediamide
CID 108944050
2-anilino-N-[2-(azepan-1-yl)ethyl]acetamide
CID 61240014
N-[4-(diethylamino)phenyl]-2,2-dimethyl-3-morpholin-4-yl-3-oxopropanamide
CID 108959945

Frequently Asked Questions

What is the IUPAC name of 2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide (CID 108994999) is 2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide is CCN(CC)c1ccc(NCC(=O)NCCN2CCOCC2)cc1.
What is the InChIKey of 2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is RKFWGLOANQFZES-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O2/c1-3-22(4-2)17-7-5-16(6-8-17)20-15-18(23)19-9-10-21-11-13-24-14-12-21/h5-8,20H,3-4,9-15H2,1-2H3,(H,19,23).
What are the key properties of 2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide?
2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 334.46 g/mol, XLogP of 1.39, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(diethylamino)anilino]-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 108994999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).