2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide

C23H21FN2O3 — CID 24648997

IUPAC2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide
SMILESCOc1ccc(C(NC(=O)CNC(=O)c2ccccc2F)c2ccccc2)cc1
InChIInChI=1S/C23H21FN2O3/c1-29-18-13-11-17(12-14-18)22(16-7-3-2-4-8-16)26-21(27)15-25-23(28)19-9-5-6-10-20(19)24/h2-14,22H,15H2,1H3,(H,25,28)(H,26,27)
InChIKeyYUGIJIOJHGJAPL-UHFFFAOYSA-N
MW392.43 g/mol
LogP3.47
Rot. Bonds7

About 2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide

2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide (PubChem CID 24648997) has the molecular formula C23H21FN2O3 and a molecular weight of 392.43 g/mol. Its IUPAC name is 2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide
PubChem CID24648997
Molecular FormulaC23H21FN2O3
Molecular Weight392.43 g/mol
Exact Mass392.15
IUPAC Name2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide
SMILESCOc1ccc(C(NC(=O)CNC(=O)c2ccccc2F)c2ccccc2)cc1
InChIInChI=1S/C23H21FN2O3/c1-29-18-13-11-17(12-14-18)22(16-7-3-2-4-8-16)26-21(27)15-25-23(28)19-9-5-6-10-20(19)24/h2-14,22H,15H2,1H3,(H,25,28)(H,26,27)
InChIKeyYUGIJIOJHGJAPL-UHFFFAOYSA-N
XLogP3.47
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.43
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]benzamide
CID 9165878
N-[2-[[(4-chlorophenyl)-phenylmethyl]amino]-2-oxoethyl]-2-methoxybenzamide
CID 112772541
N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]-4-propan-2-yloxybenzamide
CID 24649004
methyl (3R)-3-[[2-[(2-fluorobenzoyl)amino]acetyl]amino]-3-phenylpropanoate
CID 40856393
N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]-3,4-dimethylbenzamide
CID 24649003
2-fluoro-N-[2-[[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]amino]-2-oxoethyl]benzamide
CID 18161663
N-[2-(1,1-diphenylpropan-2-ylamino)-2-oxoethyl]-2-fluorobenzamide
CID 42959561
3-bromo-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide
CID 17435888
3-bromo-N-[2-[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide
CID 40789490
2-fluoro-N-[2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]-2-oxoethyl]benzamide
CID 17406382
2-anilino-N-[bis(4-methoxyphenyl)methyl]acetamide
CID 18197509
N-[(4-fluorophenyl)-phenylmethyl]-2-(4-methoxyphenoxy)acetamide
CID 55583125

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide?
The IUPAC name of 2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide (CID 24648997) is 2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide?
The canonical SMILES for 2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide is COc1ccc(C(NC(=O)CNC(=O)c2ccccc2F)c2ccccc2)cc1.
What is the InChIKey of 2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide?
The InChIKey is YUGIJIOJHGJAPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21FN2O3/c1-29-18-13-11-17(12-14-18)22(16-7-3-2-4-8-16)26-21(27)15-25-23(28)19-9-5-6-10-20(19)24/h2-14,22H,15H2,1H3,(H,25,28)(H,26,27).
What are the key properties of 2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide?
2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide has a molecular weight of 392.43 g/mol, XLogP of 3.47, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 24648997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).