N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide

C22H24FNO — CID 71899779

IUPACN-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide
SMILESCN(C(=O)C1CC2CCC1C2)C(c1ccccc1)c1ccc(F)cc1
InChIInChI=1S/C22H24FNO/c1-24(22(25)20-14-15-7-8-18(20)13-15)21(16-5-3-2-4-6-16)17-9-11-19(23)12-10-17/h2-6,9-12,15,18,20-21H,7-8,13-14H2,1H3
InChIKeyIYBCCUAWIHSZMS-UHFFFAOYSA-N
MW337.44 g/mol
LogP4.81
Rot. Bonds4

About N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide

N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide (PubChem CID 71899779) has the molecular formula C22H24FNO and a molecular weight of 337.44 g/mol. Its IUPAC name is N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide
PubChem CID71899779
Molecular FormulaC22H24FNO
Molecular Weight337.44 g/mol
Exact Mass337.18
IUPAC NameN-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide
SMILESCN(C(=O)C1CC2CCC1C2)C(c1ccccc1)c1ccc(F)cc1
InChIInChI=1S/C22H24FNO/c1-24(22(25)20-14-15-7-8-18(20)13-15)21(16-5-3-2-4-6-16)17-9-11-19(23)12-10-17/h2-6,9-12,15,18,20-21H,7-8,13-14H2,1H3
InChIKeyIYBCCUAWIHSZMS-UHFFFAOYSA-N
XLogP4.81
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.44
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(1S,2S,4S)-N-[(S)-(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide
CID 98785707
N-benzhydryl-2-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-N-methylacetamide
CID 21174649
N-(1-phenylethyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 3272708
(1S,2R,4S)-N,N-dimethylbicyclo[2.2.1]heptane-2-carboxamide
CID 100572588
N-[bis(4-fluorophenyl)methyl]-N-methylacetamide
CID 22660932
N-benzhydryl-N-methyloxirane-2-carboxamide
CID 154879943
N-(1-chloropropan-2-yl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide
CID 104555749
N-[(4-fluorophenyl)-phenylmethyl]-N-methyl-3-phenylpropanamide
CID 42935777
N-(1,3-benzothiazol-2-yl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide
CID 47141340
(1S,2R,4S)-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide
CID 98785770
N-benzyl-N-phenylbicyclo[2.2.1]heptane-2-carboxamide
CID 75853875
N-[cyclopropyl(phenyl)methyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 51296083

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide?
The IUPAC name of N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide (CID 71899779) is N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide.
What is the SMILES notation for N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide?
The canonical SMILES for N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide is CN(C(=O)C1CC2CCC1C2)C(c1ccccc1)c1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide?
The InChIKey is IYBCCUAWIHSZMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24FNO/c1-24(22(25)20-14-15-7-8-18(20)13-15)21(16-5-3-2-4-6-16)17-9-11-19(23)12-10-17/h2-6,9-12,15,18,20-21H,7-8,13-14H2,1H3.
What are the key properties of N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide?
N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide has a molecular weight of 337.44 g/mol, XLogP of 4.81, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)-phenylmethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide is sourced from PubChem (CID 71899779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).