N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide

C16H23FN2O — CID 79055402

IUPACN-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide
SMILESCc1cc(F)cc(NC(C)C(=O)NC2CCCCC2)c1
InChIInChI=1S/C16H23FN2O/c1-11-8-13(17)10-15(9-11)18-12(2)16(20)19-14-6-4-3-5-7-14/h8-10,12,14,18H,3-7H2,1-2H3,(H,19,20)
InChIKeyWOIPAZOVMQAHIE-UHFFFAOYSA-N
MW278.37 g/mol
LogP3.38
Rot. Bonds4

About N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide

N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide (PubChem CID 79055402) has the molecular formula C16H23FN2O and a molecular weight of 278.37 g/mol. Its IUPAC name is N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide
PubChem CID79055402
Molecular FormulaC16H23FN2O
Molecular Weight278.37 g/mol
Exact Mass278.18
IUPAC NameN-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide
SMILESCc1cc(F)cc(NC(C)C(=O)NC2CCCCC2)c1
InChIInChI=1S/C16H23FN2O/c1-11-8-13(17)10-15(9-11)18-12(2)16(20)19-14-6-4-3-5-7-14/h8-10,12,14,18H,3-7H2,1-2H3,(H,19,20)
InChIKeyWOIPAZOVMQAHIE-UHFFFAOYSA-N
XLogP3.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-2-(3,5-dimethylanilino)propanamide
CID 43083597
N-cyclohexyl-2-(3-fluoroanilino)propanamide
CID 43083427
N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide
CID 83077775
(2S)-2-(4-bromo-3-methylanilino)-N-cyclohexylpropanamide
CID 7043625
2-(3-chloro-4-fluoroanilino)-N-cyclohexylpropanamide
CID 78907261
(2R)-2-(4-bromoanilino)-N-cyclopentylpropanamide
CID 8005833
2-(5-bromo-2,4-difluoroanilino)-N-cyclohexylpropanamide
CID 102853387
N-cyclopropyl-2-(4-methylanilino)propanamide
CID 43085895
2-[(5-bromo-3-pyridinyl)amino]-N-cyclopentylpropanamide
CID 113350201
(2S)-2-(3-acetamidoanilino)-N-cyclohexylpropanamide
CID 40680935
(2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide
CID 28827851
2-(4-bromo-2-fluoroanilino)-N-cyclopentylpropanamide
CID 43088713

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide?
The IUPAC name of N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide (CID 79055402) is N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide.
What is the SMILES notation for N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide?
The canonical SMILES for N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide is Cc1cc(F)cc(NC(C)C(=O)NC2CCCCC2)c1.
What is the InChIKey of N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide?
The InChIKey is WOIPAZOVMQAHIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O/c1-11-8-13(17)10-15(9-11)18-12(2)16(20)19-14-6-4-3-5-7-14/h8-10,12,14,18H,3-7H2,1-2H3,(H,19,20).
What are the key properties of N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide?
N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide has a molecular weight of 278.37 g/mol, XLogP of 3.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide is sourced from PubChem (CID 79055402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).