N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide

C20H25N3O3 — CID 47033000

IUPACN-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)NC(c1ccccc1)C(C)C
InChIInChI=1S/C20H25N3O3/c1-13(2)19(15-8-6-5-7-9-15)23-20(25)22-17-12-16(21-14(3)24)10-11-18(17)26-4/h5-13,19H,1-4H3,(H,21,24)(H2,22,23,25)
InChIKeySTRAQFLMJLBWCP-UHFFFAOYSA-N
MW355.44 g/mol
LogP4.17
Rot. Bonds6

About N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide

N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide (PubChem CID 47033000) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide
PubChem CID47033000
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC NameN-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)NC(c1ccccc1)C(C)C
InChIInChI=1S/C20H25N3O3/c1-13(2)19(15-8-6-5-7-9-15)23-20(25)22-17-12-16(21-14(3)24)10-11-18(17)26-4/h5-13,19H,1-4H3,(H,21,24)(H2,22,23,25)
InChIKeySTRAQFLMJLBWCP-UHFFFAOYSA-N
XLogP4.17
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 54.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-methoxy-3-(2-phenylpropylcarbamoylamino)phenyl]acetamide
CID 47033004
N-[4-methoxy-3-[[(2S)-4-phenylbutan-2-yl]carbamoylamino]phenyl]acetamide
CID 52505927
N-[4-methoxy-3-[[(2R)-4-phenylbutan-2-yl]carbamoylamino]phenyl]acetamide
CID 52505928
N-[3-[1-(3-chlorophenyl)ethylcarbamoylamino]-4-methoxyphenyl]acetamide
CID 47033008
N-[3-[[(2S,3S)-4-hydroxy-3-methylbutan-2-yl]carbamoylamino]-4-methoxyphenyl]acetamide
CID 95775570
N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride
CID 119266368
1-[(1S)-2-methyl-1-phenylpropyl]-3-phenylurea
CID 27734199
1-(2,5-dimethoxyphenyl)-3-[(1R)-1-phenylethyl]urea
CID 40636304
1-(2,5-dimethoxyphenyl)-3-[(1S)-1-phenylethyl]urea
CID 40636303
N-(3-acetamido-4-methoxyphenyl)-2-phenylsulfanylpropanamide
CID 46542331
2-(5-acetamido-2-methoxyanilino)-N-cyclopropyl-2-phenylacetamide
CID 17428047
N-(3-acetamido-4-methoxyphenyl)-2-amino-3-methylbutanamide
CID 119278958

Frequently Asked Questions

What is the IUPAC name of N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide?
The IUPAC name of N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide (CID 47033000) is N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide?
The canonical SMILES for N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide is COc1ccc(NC(C)=O)cc1NC(=O)NC(c1ccccc1)C(C)C.
What is the InChIKey of N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide?
The InChIKey is STRAQFLMJLBWCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-13(2)19(15-8-6-5-7-9-15)23-20(25)22-17-12-16(21-14(3)24)10-11-18(17)26-4/h5-13,19H,1-4H3,(H,21,24)(H2,22,23,25).
What are the key properties of N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide?
N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide has a molecular weight of 355.44 g/mol, XLogP of 4.17, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methoxy-3-[(2-methyl-1-phenylpropyl)carbamoylamino]phenyl]acetamide is sourced from PubChem (CID 47033000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).