2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide

C20H26N4O3 — CID 72888813

IUPAC2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide
SMILESCOCC(=O)Nc1cccc(NC(=O)NCCN(C)c2ccccc2)c1C
InChIInChI=1S/C20H26N4O3/c1-15-17(22-19(25)14-27-3)10-7-11-18(15)23-20(26)21-12-13-24(2)16-8-5-4-6-9-16/h4-11H,12-14H2,1-3H3,(H,22,25)(H2,21,23,26)
InChIKeyVEUKWRZAZLWXLW-UHFFFAOYSA-N
MW370.45 g/mol
LogP2.84
Rot. Bonds8

About 2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide

2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide (PubChem CID 72888813) has the molecular formula C20H26N4O3 and a molecular weight of 370.45 g/mol. Its IUPAC name is 2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide
PubChem CID72888813
Molecular FormulaC20H26N4O3
Molecular Weight370.45 g/mol
Exact Mass370.20
IUPAC Name2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide
SMILESCOCC(=O)Nc1cccc(NC(=O)NCCN(C)c2ccccc2)c1C
InChIInChI=1S/C20H26N4O3/c1-15-17(22-19(25)14-27-3)10-7-11-18(15)23-20(26)21-12-13-24(2)16-8-5-4-6-9-16/h4-11H,12-14H2,1-3H3,(H,22,25)(H2,21,23,26)
InChIKeyVEUKWRZAZLWXLW-UHFFFAOYSA-N
XLogP2.84
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 52.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-chloro-2-(2-methoxyethoxy)phenyl]-3-[3-(N-methylanilino)propyl]urea
CID 60594806
N-[3-[3-(3,5-dimethyl-1,2,4-triazol-1-yl)propylcarbamoylamino]-2-methylphenyl]-2-methoxyacetamide
CID 118783002
1-(2,5-dimethylphenyl)-3-[3-(N-methylanilino)propyl]urea
CID 3822405
1-[2-(dimethylamino)ethyl]-3-(3-iodo-2-methylphenyl)urea
CID 75519151
2-chloro-N-[2-(N-methylanilino)ethyl]propanamide
CID 43168070
1-N,4-N-bis[2-(N-methylanilino)ethyl]benzene-1,4-dicarboxamide
CID 35617422
N-(3-azido-2-methylphenyl)-2-methoxyacetamide
CID 169324993
1-[2-(N-methylanilino)ethyl]-3-(3-nitrophenyl)urea
CID 27870936
1-(3-methoxyphenyl)-3-[3-(N-methylanilino)propyl]urea
CID 51290296
3-(tert-butylamino)-N-[2-(N-methylanilino)ethyl]propanamide
CID 61260104
1-(2-hydroxy-2-phenylpropyl)-3-[2-(N-methylanilino)ethyl]urea
CID 111335704
2-(2-chlorophenyl)-N-[2-(N-methylanilino)ethyl]acetamide
CID 94476681

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide?
The IUPAC name of 2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide (CID 72888813) is 2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide?
The canonical SMILES for 2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide is COCC(=O)Nc1cccc(NC(=O)NCCN(C)c2ccccc2)c1C.
What is the InChIKey of 2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide?
The InChIKey is VEUKWRZAZLWXLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O3/c1-15-17(22-19(25)14-27-3)10-7-11-18(15)23-20(26)21-12-13-24(2)16-8-5-4-6-9-16/h4-11H,12-14H2,1-3H3,(H,22,25)(H2,21,23,26).
What are the key properties of 2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide?
2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide has a molecular weight of 370.45 g/mol, XLogP of 2.84, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-methyl-3-[2-(N-methylanilino)ethylcarbamoylamino]phenyl]acetamide is sourced from PubChem (CID 72888813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).