N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide

C19H29N3O5 — CID 113053665

IUPACN-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide
SMILESCOc1cccc(OC)c1C(=O)NCCN(CCN1CCOCC1)C(C)=O
InChIInChI=1S/C19H29N3O5/c1-15(23)22(10-9-21-11-13-27-14-12-21)8-7-20-19(24)18-16(25-2)5-4-6-17(18)26-3/h4-6H,7-14H2,1-3H3,(H,20,24)
InChIKeyMSBGWLJBTOGCIU-UHFFFAOYSA-N
MW379.46 g/mol
LogP0.61
Rot. Bonds9

About N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide

N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide (PubChem CID 113053665) has the molecular formula C19H29N3O5 and a molecular weight of 379.46 g/mol. Its IUPAC name is N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide.

Molecular Properties

Compound NameN-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide
PubChem CID113053665
Molecular FormulaC19H29N3O5
Molecular Weight379.46 g/mol
Exact Mass379.21
IUPAC NameN-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide
SMILESCOc1cccc(OC)c1C(=O)NCCN(CCN1CCOCC1)C(C)=O
InChIInChI=1S/C19H29N3O5/c1-15(23)22(10-9-21-11-13-27-14-12-21)8-7-20-19(24)18-16(25-2)5-4-6-17(18)26-3/h4-6H,7-14H2,1-3H3,(H,20,24)
InChIKeyMSBGWLJBTOGCIU-UHFFFAOYSA-N
XLogP0.61
TPSA80.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-methoxy-6-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 131898398
N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide
CID 113053679
N-[2-[acetyl-[2-(dimethylamino)ethyl]amino]ethyl]-2,6-dimethoxybenzamide
CID 113053535
3-[acetyl(2-morpholin-4-ylethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide
CID 113117675
2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-(2-morpholin-4-ylethyl)acetamide
CID 113164494
3-[acetyl(2-morpholin-4-ylethyl)amino]-N-(3,4-dimethoxyphenyl)propanamide
CID 113117763
3-(N-acetyl-2-methoxyanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 113128713
N-[2-(benzenesulfonamido)ethyl]-N-(2-morpholin-4-ylethyl)acetamide
CID 113053710
N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-3-methylbutanamide
CID 113053643
N-[2-[acetyl-[(2-chlorophenyl)methyl]amino]ethyl]-2,6-dimethoxybenzamide
CID 113054757
3-[acetyl(2-morpholin-4-ylethyl)amino]-N-(3-chloro-4-methoxyphenyl)propanamide
CID 113117750
2-(2-methoxyphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 806992

Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide?
The IUPAC name of N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide (CID 113053665) is N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide.
What is the SMILES notation for N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide?
The canonical SMILES for N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide is COc1cccc(OC)c1C(=O)NCCN(CCN1CCOCC1)C(C)=O.
What is the InChIKey of N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide?
The InChIKey is MSBGWLJBTOGCIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O5/c1-15(23)22(10-9-21-11-13-27-14-12-21)8-7-20-19(24)18-16(25-2)5-4-6-17(18)26-3/h4-6H,7-14H2,1-3H3,(H,20,24).
What are the key properties of N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide?
N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide has a molecular weight of 379.46 g/mol, XLogP of 0.61, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide is sourced from PubChem (CID 113053665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).