N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide

C24H21F2NO — CID 59058079

IUPACN-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccc(CC2CCc3ccccc3C2)cc1
InChIInChI=1S/C24H21F2NO/c25-21-11-12-23(22(26)15-21)27-24(28)19-9-5-16(6-10-19)13-17-7-8-18-3-1-2-4-20(18)14-17/h1-6,9-12,15,17H,7-8,13-14H2,(H,27,28)
InChIKeyKMODXTHBOJGFIA-UHFFFAOYSA-N
MW377.43 g/mol
LogP5.56
Rot. Bonds4

About N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide

N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide (PubChem CID 59058079) has the molecular formula C24H21F2NO and a molecular weight of 377.43 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide
PubChem CID59058079
Molecular FormulaC24H21F2NO
Molecular Weight377.43 g/mol
Exact Mass377.16
IUPAC NameN-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccc(CC2CCc3ccccc3C2)cc1
InChIInChI=1S/C24H21F2NO/c25-21-11-12-23(22(26)15-21)27-24(28)19-9-5-16(6-10-19)13-17-7-8-18-3-1-2-4-20(18)14-17/h1-6,9-12,15,17H,7-8,13-14H2,(H,27,28)
InChIKeyKMODXTHBOJGFIA-UHFFFAOYSA-N
XLogP5.56
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.43
LogP ≤ 55.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826
N-(2,4-difluorophenyl)-4-(2,3-dihydroindol-1-ylmethyl)benzamide
CID 92674557
N-(2,4-difluorophenyl)-4-ethylbenzamide
CID 2478391
N-(2,4-difluorophenyl)-4-(3,4-dihydro-2H-quinolin-1-ylmethyl)benzamide
CID 38005181
1-N-(2,4-difluorophenyl)-4-N-(2-ethylphenyl)benzene-1,4-dicarboxamide
CID 109049743
N-(2,4-difluorophenyl)-4-(methylsulfonylmethyl)benzamide
CID 9095339
4-(acetamidomethyl)-N-(2,4-difluorophenyl)benzamide
CID 18195856
1-benzyl-3-(2,4-difluorophenyl)-1-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)urea
CID 70370290
4-N-(2,4-difluorophenyl)-1-N-[(4-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046989
1-N,2-N-bis(2,4-difluorophenyl)benzene-1,2-dicarboxamide
CID 4062467
N-[(6R,7R)-7-(4-benzylpiperidin-1-yl)-6-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl]-4-fluorobenzamide
CID 122181078
tert-butyl N-[[4-[(2,4-difluorophenyl)carbamoyl]phenyl]methyl]carbamate
CID 9078733

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide?
The IUPAC name of N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide (CID 59058079) is N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide?
The canonical SMILES for N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide is O=C(Nc1ccc(F)cc1F)c1ccc(CC2CCc3ccccc3C2)cc1.
What is the InChIKey of N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide?
The InChIKey is KMODXTHBOJGFIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21F2NO/c25-21-11-12-23(22(26)15-21)27-24(28)19-9-5-16(6-10-19)13-17-7-8-18-3-1-2-4-20(18)14-17/h1-6,9-12,15,17H,7-8,13-14H2,(H,27,28).
What are the key properties of N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide?
N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide has a molecular weight of 377.43 g/mol, XLogP of 5.56, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-4-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)benzamide is sourced from PubChem (CID 59058079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).