N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide

C20H25N3O5 — CID 1428113

IUPACN-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide
SMILESCCOc1cc(NC(=O)Nc2ccccc2OC)c(OCC)cc1NC(C)=O
InChIInChI=1S/C20H25N3O5/c1-5-27-18-12-16(19(28-6-2)11-15(18)21-13(3)24)23-20(25)22-14-9-7-8-10-17(14)26-4/h7-12H,5-6H2,1-4H3,(H,21,24)(H2,22,23,25)
InChIKeySMLXCHBAEZGDKI-UHFFFAOYSA-N
MW387.44 g/mol
LogP4.09
Rot. Bonds8

About N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide

N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide (PubChem CID 1428113) has the molecular formula C20H25N3O5 and a molecular weight of 387.44 g/mol. Its IUPAC name is N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide
PubChem CID1428113
Molecular FormulaC20H25N3O5
Molecular Weight387.44 g/mol
Exact Mass387.18
IUPAC NameN-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide
SMILESCCOc1cc(NC(=O)Nc2ccccc2OC)c(OCC)cc1NC(C)=O
InChIInChI=1S/C20H25N3O5/c1-5-27-18-12-16(19(28-6-2)11-15(18)21-13(3)24)23-20(25)22-14-9-7-8-10-17(14)26-4/h7-12H,5-6H2,1-4H3,(H,21,24)(H2,22,23,25)
InChIKeySMLXCHBAEZGDKI-UHFFFAOYSA-N
XLogP4.09
TPSA97.92 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 54.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(3,4-diethoxyphenyl)methyl]-3-(2-methoxyphenyl)urea
CID 100747631
3,4-diethoxy-N-(2-methoxyphenyl)benzamide
CID 669527
1-[3-(2-ethoxyphenyl)propyl]-3-(2-methoxyphenyl)urea
CID 100747319
1-[1-(3,4-diethoxyphenyl)ethyl]-3-(2-methoxyphenyl)urea
CID 133204349
[(2S)-1-(2-methoxyanilino)-1-oxopropan-2-yl] 2-ethoxybenzoate
CID 2629891
4-N-(2-ethoxyphenyl)-1-N-(2-methoxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109151014
(2R)-2-(4-acetyl-2-methoxyphenoxy)-N-(2-ethoxyphenyl)propanamide
CID 8730577
3-(3,4-diethoxyphenyl)-N-(2-methoxyphenyl)prop-2-enamide
CID 732806
methyl 3-(2-ethoxyanilino)-3-oxopropanoate
CID 28637956
N-(2-ethoxyphenyl)-2-(2-methoxyphenoxy)acetamide
CID 3891399
1-[2-(2-methoxyphenoxy)ethyl]-3-(2-methoxyphenyl)urea
CID 17171255
1-(2-ethoxyphenyl)-3-(2-methoxyethyl)urea
CID 47032357

Frequently Asked Questions

What is the IUPAC name of N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide?
The IUPAC name of N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide (CID 1428113) is N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide.
What is the SMILES notation for N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide?
The canonical SMILES for N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide is CCOc1cc(NC(=O)Nc2ccccc2OC)c(OCC)cc1NC(C)=O.
What is the InChIKey of N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide?
The InChIKey is SMLXCHBAEZGDKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O5/c1-5-27-18-12-16(19(28-6-2)11-15(18)21-13(3)24)23-20(25)22-14-9-7-8-10-17(14)26-4/h7-12H,5-6H2,1-4H3,(H,21,24)(H2,22,23,25).
What are the key properties of N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide?
N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide has a molecular weight of 387.44 g/mol, XLogP of 4.09, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide is sourced from PubChem (CID 1428113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).