N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide

C25H27NO4 — CID 175079399

IUPACN-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(C(C)C(=O)NC(c2ccccc2OC)c2ccccc2OC)cc1
InChIInChI=1S/C25H27NO4/c1-17(18-13-15-19(28-2)16-14-18)25(27)26-24(20-9-5-7-11-22(20)29-3)21-10-6-8-12-23(21)30-4/h5-17,24H,1-4H3,(H,26,27)
InChIKeyRRFWYMZYQWITGM-UHFFFAOYSA-N
MW405.49 g/mol
LogP4.72
Rot. Bonds8

About N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide

N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide (PubChem CID 175079399) has the molecular formula C25H27NO4 and a molecular weight of 405.49 g/mol. Its IUPAC name is N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide
PubChem CID175079399
Molecular FormulaC25H27NO4
Molecular Weight405.49 g/mol
Exact Mass405.19
IUPAC NameN-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(C(C)C(=O)NC(c2ccccc2OC)c2ccccc2OC)cc1
InChIInChI=1S/C25H27NO4/c1-17(18-13-15-19(28-2)16-14-18)25(27)26-24(20-9-5-7-11-22(20)29-3)21-10-6-8-12-23(21)30-4/h5-17,24H,1-4H3,(H,26,27)
InChIKeyRRFWYMZYQWITGM-UHFFFAOYSA-N
XLogP4.72
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.49
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[bis(2-methoxyphenyl)methyl]-2-(4-fluorophenyl)propanamide
CID 166439731
N-[bis(2-methoxyphenyl)methyl]-2-(4-fluorophenyl)propanamide
CID 175348426
(2R)-N-[bis(2-methoxyphenyl)methyl]-2-(3-methoxyphenyl)propanamide
CID 175077075
2,2-difluoro-N-[(R)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]acetamide
CID 100703367
ethyl 4-[(2R)-1-[bis(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl]benzoate
CID 175072041
2-(4-methoxyphenyl)-N-propan-2-ylpropanamide
CID 154459065
N-[(S)-(2-methoxyphenyl)-(4-methoxyphenyl)methyl]-2-(methylamino)acetamide
CID 129432320
(2S)-N-[(1R)-2-hydroxy-1-(4-methoxyphenyl)ethyl]-2-phenylpropanamide
CID 118730013
N-[(4-methoxyphenyl)-phenylmethyl]-2-methylpropanamide
CID 46419913
(2R)-2-[2-(4-methoxyphenyl)propanoylamino]-3-methylbutanoic acid
CID 119369486
2-(2-methoxyphenyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 40636202
(2S)-N-[1-(2-fluorophenyl)ethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 24545440

Frequently Asked Questions

What is the IUPAC name of N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide?
The IUPAC name of N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide (CID 175079399) is N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide.
What is the SMILES notation for N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide?
The canonical SMILES for N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide is COc1ccc(C(C)C(=O)NC(c2ccccc2OC)c2ccccc2OC)cc1.
What is the InChIKey of N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide?
The InChIKey is RRFWYMZYQWITGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27NO4/c1-17(18-13-15-19(28-2)16-14-18)25(27)26-24(20-9-5-7-11-22(20)29-3)21-10-6-8-12-23(21)30-4/h5-17,24H,1-4H3,(H,26,27).
What are the key properties of N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide?
N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide has a molecular weight of 405.49 g/mol, XLogP of 4.72, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis(2-methoxyphenyl)methyl]-2-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 175079399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).