4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide

C19H22N2O3 — CID 110767597

IUPAC4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide
SMILESCOc1ccc(CC(=O)Nc2ccc(C(N)=O)cc2)cc1C(C)C
InChIInChI=1S/C19H22N2O3/c1-12(2)16-10-13(4-9-17(16)24-3)11-18(22)21-15-7-5-14(6-8-15)19(20)23/h4-10,12H,11H2,1-3H3,(H2,20,23)(H,21,22)
InChIKeyIBCUWLSSLXMJCO-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.10
Rot. Bonds6

About 4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide

4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide (PubChem CID 110767597) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide.

Molecular Properties

Compound Name4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide
PubChem CID110767597
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide
SMILESCOc1ccc(CC(=O)Nc2ccc(C(N)=O)cc2)cc1C(C)C
InChIInChI=1S/C19H22N2O3/c1-12(2)16-10-13(4-9-17(16)24-3)11-18(22)21-15-7-5-14(6-8-15)19(20)23/h4-10,12H,11H2,1-3H3,(H2,20,23)(H,21,22)
InChIKeyIBCUWLSSLXMJCO-UHFFFAOYSA-N
XLogP3.10
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(4-carbamoylanilino)-2-oxoethyl] 2-(3,4-dimethoxyphenyl)acetate
CID 7766635
4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]benzoic acid
CID 2738551
[(2R)-1-(4-carbamoylanilino)-1-oxopropan-2-yl] 2-(3,4-dimethoxyphenyl)acetate
CID 7766423
4-[[2-(2,3,4-trimethoxyphenyl)acetyl]amino]benzamide
CID 17463761
4-[[2-(4-methoxy-2,3-dimethylphenyl)acetyl]amino]benzamide
CID 110769674
4-[[2-(2-oxo-3-propan-2-yl-1H-quinolin-6-yl)acetyl]amino]benzamide
CID 110675556
methyl 3-(4-methoxy-3-propan-2-ylanilino)-3-oxopropanoate
CID 115174107
N-(4-tert-butylphenyl)-2-(3,4-dimethoxyphenyl)acetamide
CID 7741769
N-(4-chlorophenyl)-2-(4-methoxy-3-methylphenyl)acetamide
CID 16848482
4-[[2-[4-(aminomethyl)phenyl]acetyl]amino]benzamide
CID 63589054
N-(3,5-dichlorophenyl)-2-(3,4-dimethoxyphenyl)acetamide
CID 3482890
4-[[2-(3-chlorophenyl)acetyl]amino]benzamide
CID 56922735

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide?
The IUPAC name of 4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide (CID 110767597) is 4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide.
What is the SMILES notation for 4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide?
The canonical SMILES for 4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide is COc1ccc(CC(=O)Nc2ccc(C(N)=O)cc2)cc1C(C)C.
What is the InChIKey of 4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide?
The InChIKey is IBCUWLSSLXMJCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-12(2)16-10-13(4-9-17(16)24-3)11-18(22)21-15-7-5-14(6-8-15)19(20)23/h4-10,12H,11H2,1-3H3,(H2,20,23)(H,21,22).
What are the key properties of 4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide?
4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide has a molecular weight of 326.40 g/mol, XLogP of 3.10, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(4-methoxy-3-propan-2-ylphenyl)acetyl]amino]benzamide is sourced from PubChem (CID 110767597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).