3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide

C22H29N3O4 — CID 146497389

IUPAC3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide
SMILESCOc1cccc(CNc2c(OC)cccc2C(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C22H29N3O4/c1-27-18-6-3-5-17(15-18)16-24-21-19(7-4-8-20(21)28-2)22(26)23-9-10-25-11-13-29-14-12-25/h3-8,15,24H,9-14,16H2,1-2H3,(H,23,26)
InChIKeyBQNHGPOPMXQKGN-UHFFFAOYSA-N
MW399.49 g/mol
LogP2.38
Rot. Bonds9

About 3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide

3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide (PubChem CID 146497389) has the molecular formula C22H29N3O4 and a molecular weight of 399.49 g/mol. Its IUPAC name is 3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide.

Molecular Properties

Compound Name3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide
PubChem CID146497389
Molecular FormulaC22H29N3O4
Molecular Weight399.49 g/mol
Exact Mass399.22
IUPAC Name3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide
SMILESCOc1cccc(CNc2c(OC)cccc2C(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C22H29N3O4/c1-27-18-6-3-5-17(15-18)16-24-21-19(7-4-8-20(21)28-2)22(26)23-9-10-25-11-13-29-14-12-25/h3-8,15,24H,9-14,16H2,1-2H3,(H,23,26)
InChIKeyBQNHGPOPMXQKGN-UHFFFAOYSA-N
XLogP2.38
TPSA72.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.49
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2,5-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide
CID 51072890
4-N-[(3-methoxyphenyl)methyl]-6-N-[[3-(2-morpholin-4-ylethylcarbamoyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide
CID 58784359
2-methoxy-6-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 131898398
2-N-[2-(3-methoxyphenyl)ethyl]-1-N-(2-morpholin-4-ylethyl)cyclopropane-1,2-dicarboxamide
CID 109133842
2-[(3-methoxyphenyl)methylamino]-4-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]pyrimidine-5-carboxamide
CID 20959676
2,3-dimethoxy-N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 55814732
2-(difluoromethoxy)-4-methoxy-N-(2-morpholin-4-ylethyl)benzamide
CID 119045783
5-(3-methoxyphenyl)-2-methyl-N-(2-morpholin-4-ylethyl)-1-phenylpyrrole-3-carboxamide
CID 7347913
5-[(3-methoxyphenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)-2-pyrrolidin-1-ylbenzamide
CID 1064254
5-(3-methoxyphenyl)-N-(2-morpholin-4-ylethyl)-1,2-oxazole-3-carboxamide
CID 3239467
5-N-(3-methoxyphenyl)-3-N-(2-morpholin-4-ylethyl)pyridine-3,5-dicarboxamide
CID 109104239
2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide
CID 154794863

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide?
The IUPAC name of 3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide (CID 146497389) is 3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide.
What is the SMILES notation for 3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide?
The canonical SMILES for 3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide is COc1cccc(CNc2c(OC)cccc2C(=O)NCCN2CCOCC2)c1.
What is the InChIKey of 3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide?
The InChIKey is BQNHGPOPMXQKGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O4/c1-27-18-6-3-5-17(15-18)16-24-21-19(7-4-8-20(21)28-2)22(26)23-9-10-25-11-13-29-14-12-25/h3-8,15,24H,9-14,16H2,1-2H3,(H,23,26).
What are the key properties of 3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide?
3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide has a molecular weight of 399.49 g/mol, XLogP of 2.38, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-[(3-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylethyl)benzamide is sourced from PubChem (CID 146497389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).