N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide

C21H17ClF2N2O — CID 60537256

IUPACN-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide
SMILESO=C(CNC(c1ccccc1)c1ccc(F)cc1)Nc1cc(Cl)ccc1F
InChIInChI=1S/C21H17ClF2N2O/c22-16-8-11-18(24)19(12-16)26-20(27)13-25-21(14-4-2-1-3-5-14)15-6-9-17(23)10-7-15/h1-12,21,25H,13H2,(H,26,27)
InChIKeyBLDDVFSYEFFOIY-UHFFFAOYSA-N
MW386.83 g/mol
LogP4.94
Rot. Bonds6

About N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide

N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide (PubChem CID 60537256) has the molecular formula C21H17ClF2N2O and a molecular weight of 386.83 g/mol. Its IUPAC name is N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide
PubChem CID60537256
Molecular FormulaC21H17ClF2N2O
Molecular Weight386.83 g/mol
Exact Mass386.10
IUPAC NameN-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide
SMILESO=C(CNC(c1ccccc1)c1ccc(F)cc1)Nc1cc(Cl)ccc1F
InChIInChI=1S/C21H17ClF2N2O/c22-16-8-11-18(24)19(12-16)26-20(27)13-25-21(14-4-2-1-3-5-14)15-6-9-17(23)10-7-15/h1-12,21,25H,13H2,(H,26,27)
InChIKeyBLDDVFSYEFFOIY-UHFFFAOYSA-N
XLogP4.94
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.83
LogP ≤ 54.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,5-difluorophenyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9393367
N-(2-chloro-4-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide
CID 60536996
N-(2-chlorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide
CID 60537351
2-(benzhydrylamino)-N-(2-chloro-4-fluorophenyl)acetamide
CID 2441188
N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide
CID 60537022
2-[[(4-chlorophenyl)-phenylmethyl]amino]-N-(2,3,4-trifluorophenyl)acetamide
CID 4858348
N-(5-chloro-2-nitrophenyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9393376
2-[[(4-fluorophenyl)-phenylmethyl]amino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 60537329
N-(5-chloro-2-fluorophenyl)-2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]acetamide
CID 9306583
N-(2-chloro-4-methylphenyl)-2-[[(S)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9392747
N-cyclopentyl-2-[[2-[[(4-fluorophenyl)-phenylmethyl]amino]acetyl]amino]benzamide
CID 60537204
2-(benzhydrylamino)-N-[1-(4-fluorophenyl)ethyl]acetamide;oxalic acid
CID 42913580

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide?
The IUPAC name of N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide (CID 60537256) is N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide.
What is the SMILES notation for N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide?
The canonical SMILES for N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide is O=C(CNC(c1ccccc1)c1ccc(F)cc1)Nc1cc(Cl)ccc1F.
What is the InChIKey of N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide?
The InChIKey is BLDDVFSYEFFOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClF2N2O/c22-16-8-11-18(24)19(12-16)26-20(27)13-25-21(14-4-2-1-3-5-14)15-6-9-17(23)10-7-15/h1-12,21,25H,13H2,(H,26,27).
What are the key properties of N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide?
N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide has a molecular weight of 386.83 g/mol, XLogP of 4.94, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-fluorophenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide is sourced from PubChem (CID 60537256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).