2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide

C20H32N4O3 — CID 26628380

IUPAC2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
SMILESCCN(CC)C(=O)CN(C)CC(=O)Nc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C20H32N4O3/c1-4-24(5-2)20(26)16-22(3)15-19(25)21-18-8-6-17(7-9-18)14-23-10-12-27-13-11-23/h6-9H,4-5,10-16H2,1-3H3,(H,21,25)
InChIKeyBTCRKFMLPWCLDG-UHFFFAOYSA-N
MW376.50 g/mol
LogP1.26
Rot. Bonds9

About 2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide

2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide (PubChem CID 26628380) has the molecular formula C20H32N4O3 and a molecular weight of 376.50 g/mol. Its IUPAC name is 2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
PubChem CID26628380
Molecular FormulaC20H32N4O3
Molecular Weight376.50 g/mol
Exact Mass376.25
IUPAC Name2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
SMILESCCN(CC)C(=O)CN(C)CC(=O)Nc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C20H32N4O3/c1-4-24(5-2)20(26)16-22(3)15-19(25)21-18-8-6-17(7-9-18)14-23-10-12-27-13-11-23/h6-9H,4-5,10-16H2,1-3H3,(H,21,25)
InChIKeyBTCRKFMLPWCLDG-UHFFFAOYSA-N
XLogP1.26
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
The IUPAC name of 2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide (CID 26628380) is 2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide.
What is the SMILES notation for 2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
The canonical SMILES for 2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide is CCN(CC)C(=O)CN(C)CC(=O)Nc1ccc(CN2CCOCC2)cc1.
What is the InChIKey of 2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
The InChIKey is BTCRKFMLPWCLDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N4O3/c1-4-24(5-2)20(26)16-22(3)15-19(25)21-18-8-6-17(7-9-18)14-23-10-12-27-13-11-23/h6-9H,4-5,10-16H2,1-3H3,(H,21,25).
What are the key properties of 2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide has a molecular weight of 376.50 g/mol, XLogP of 1.26, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide is sourced from PubChem (CID 26628380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).