N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide

C24H26N2O3 — CID 86585756

IUPACN-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide
SMILESCCCc1ccc(CNc2cc(O)ccc2NC(=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H26N2O3/c1-3-4-17-5-7-18(8-6-17)16-25-23-15-20(27)11-14-22(23)26-24(28)19-9-12-21(29-2)13-10-19/h5-15,25,27H,3-4,16H2,1-2H3,(H,26,28)
InChIKeyWSJWVPRJTLDXMA-UHFFFAOYSA-N
MW390.48 g/mol
LogP5.22
Rot. Bonds8

About N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide

N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide (PubChem CID 86585756) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide
PubChem CID86585756
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC NameN-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide
SMILESCCCc1ccc(CNc2cc(O)ccc2NC(=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H26N2O3/c1-3-4-17-5-7-18(8-6-17)16-25-23-15-20(27)11-14-22(23)26-24(28)19-9-12-21(29-2)13-10-19/h5-15,25,27H,3-4,16H2,1-2H3,(H,26,28)
InChIKeyWSJWVPRJTLDXMA-UHFFFAOYSA-N
XLogP5.22
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.48
LogP ≤ 55.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

N-(2,4-dihydroxyphenyl)-4-methoxybenzamide
CID 141075428
N-(2-chloro-4-hydroxyphenyl)-4-methoxybenzamide;N-(2-chloro-4-methoxyphenyl)-4-methoxybenzamide
CID 86605166
N-(2-aminophenyl)-4-[(4-methoxy-2-methylanilino)methyl]benzamide
CID 22478761
N-ethyl-4-[(4-methoxyphenyl)methylamino]benzamide
CID 43728493
4-methoxy-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113041761
4-(2-aminoethyl)-N-(2-hydroxy-5-methoxyphenyl)benzamide
CID 102695549
N-[2,5-dimethoxy-4-[[2-(4-propylphenoxy)acetyl]amino]phenyl]benzamide
CID 19180504
N-[2-[(4-butoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 10811951
1-(4-methoxyphenyl)-2-(4-propylphenyl)ethanone
CID 71380079
2-[[4-[(2-hydroxyanilino)methyl]phenyl]methylamino]phenol;methyl 3-hydroxy-4-[[4-[(2-hydroxy-4-methoxycarbonylphenyl)carbamoyl]benzoyl]amino]benzoate
CID 143099197
4-N-[2-(4-methoxyphenyl)ethyl]-1-N-propylbenzene-1,4-dicarboxamide
CID 109042916
2,4-dimethoxy-N-[(4-methoxyphenyl)methyl]aniline
CID 18316983

Frequently Asked Questions

What is the IUPAC name of N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide?
The IUPAC name of N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide (CID 86585756) is N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide.
What is the SMILES notation for N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide?
The canonical SMILES for N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide is CCCc1ccc(CNc2cc(O)ccc2NC(=O)c2ccc(OC)cc2)cc1.
What is the InChIKey of N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide?
The InChIKey is WSJWVPRJTLDXMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-3-4-17-5-7-18(8-6-17)16-25-23-15-20(27)11-14-22(23)26-24(28)19-9-12-21(29-2)13-10-19/h5-15,25,27H,3-4,16H2,1-2H3,(H,26,28).
What are the key properties of N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide?
N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide has a molecular weight of 390.48 g/mol, XLogP of 5.22, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide is sourced from PubChem (CID 86585756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).