4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide

C22H28N2O3 — CID 60537571

IUPAC4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide
SMILESCCC(C)C(C(=O)Nc1cc(C(=O)N(C)C)ccc1OC)c1ccccc1
InChIInChI=1S/C22H28N2O3/c1-6-15(2)20(16-10-8-7-9-11-16)21(25)23-18-14-17(22(26)24(3)4)12-13-19(18)27-5/h7-15,20H,6H2,1-5H3,(H,23,25)
InChIKeyLSPLHWIEHLNQNO-UHFFFAOYSA-N
MW368.48 g/mol
LogP4.17
Rot. Bonds7

About 4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide

4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide (PubChem CID 60537571) has the molecular formula C22H28N2O3 and a molecular weight of 368.48 g/mol. Its IUPAC name is 4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide.

Molecular Properties

Compound Name4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide
PubChem CID60537571
Molecular FormulaC22H28N2O3
Molecular Weight368.48 g/mol
Exact Mass368.21
IUPAC Name4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide
SMILESCCC(C)C(C(=O)Nc1cc(C(=O)N(C)C)ccc1OC)c1ccccc1
InChIInChI=1S/C22H28N2O3/c1-6-15(2)20(16-10-8-7-9-11-16)21(25)23-18-14-17(22(26)24(3)4)12-13-19(18)27-5/h7-15,20H,6H2,1-5H3,(H,23,25)
InChIKeyLSPLHWIEHLNQNO-UHFFFAOYSA-N
XLogP4.17
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluoro-2-methoxyphenyl)-3-methyl-2-phenylpentanamide
CID 55593206
4-methoxy-N,N-dimethyl-3-(propylcarbamoylamino)benzamide
CID 47325512
3-[[(2S)-2-amino-3-methylpentanoyl]amino]-4-methoxybenzoic acid
CID 63744628
3-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-methoxybenzoic acid
CID 63742251
4-ethoxy-N,N-dimethyl-3-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide
CID 119816573
[2-(2-methoxy-5-methylanilino)-2-oxoethyl] (2R,3S)-3-methyl-2-phenylpentanoate
CID 7772946
(2S,3R)-N-(2,5-dimethylphenyl)-3-methyl-2-phenylpentanamide
CID 8712534
N-(5-benzoyl-2-methoxyphenyl)-2-methylpropanamide
CID 56687266
3-[[benzyl-[2-(dimethylamino)ethyl]carbamoyl]amino]-4-methoxy-N,N-dimethylbenzamide
CID 60543557
3-[[2-(dimethylamino)-2-(furan-2-yl)ethyl]carbamoylamino]-4-methoxy-N,N-dimethylbenzamide
CID 60543252
4-[(3-amino-2-methyl-3-phenylpropanoyl)amino]-3-ethoxy-N,N-dimethylbenzamide;hydrochloride
CID 119812590
4-methoxy-3-(2-methylpropanoylamino)benzoic acid
CID 63742748

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide?
The IUPAC name of 4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide (CID 60537571) is 4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide.
What is the SMILES notation for 4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide?
The canonical SMILES for 4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide is CCC(C)C(C(=O)Nc1cc(C(=O)N(C)C)ccc1OC)c1ccccc1.
What is the InChIKey of 4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide?
The InChIKey is LSPLHWIEHLNQNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O3/c1-6-15(2)20(16-10-8-7-9-11-16)21(25)23-18-14-17(22(26)24(3)4)12-13-19(18)27-5/h7-15,20H,6H2,1-5H3,(H,23,25).
What are the key properties of 4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide?
4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide has a molecular weight of 368.48 g/mol, XLogP of 4.17, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,N-dimethyl-3-[(3-methyl-2-phenylpentanoyl)amino]benzamide is sourced from PubChem (CID 60537571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).