N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide

C17H22FNO — CID 61053717

IUPACN-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide
SMILESO=C(c1ccc(F)cc1)N(CC1CCCCC1)C1CC1
InChIInChI=1S/C17H22FNO/c18-15-8-6-14(7-9-15)17(20)19(16-10-11-16)12-13-4-2-1-3-5-13/h6-9,13,16H,1-5,10-12H2
InChIKeyKWINYRABWACTDO-UHFFFAOYSA-N
MW275.37 g/mol
LogP4.01
Rot. Bonds4

About N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide

N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide (PubChem CID 61053717) has the molecular formula C17H22FNO and a molecular weight of 275.37 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide
PubChem CID61053717
Molecular FormulaC17H22FNO
Molecular Weight275.37 g/mol
Exact Mass275.17
IUPAC NameN-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide
SMILESO=C(c1ccc(F)cc1)N(CC1CCCCC1)C1CC1
InChIInChI=1S/C17H22FNO/c18-15-8-6-14(7-9-15)17(20)19(16-10-11-16)12-13-4-2-1-3-5-13/h6-9,13,16H,1-5,10-12H2
InChIKeyKWINYRABWACTDO-UHFFFAOYSA-N
XLogP4.01
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(chloromethyl)-N-(cyclohexylmethyl)-N-cyclopropylbenzamide
CID 60949844
N-cyclopropyl-4-fluoro-N-[[(3S)-oxolan-3-yl]methyl]benzamide
CID 129365728
2-bromo-N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide
CID 60956169
N,N-dicyclohexyl-4-fluorobenzamide
CID 784952
3,5-dibromo-N-(cyclohexylmethyl)-N-cyclopropylbenzamide
CID 107980320
3-amino-N-(cyclohexylmethyl)-N-cyclopropyl-4-methylbenzamide
CID 60963343
3-[cyclopentyl-(4-fluorobenzoyl)amino]propanoic acid
CID 82324866
N-(2-bromoethyl)-N-cyclobutyl-4-fluorobenzamide
CID 102873060
N-(cyclohexylmethyl)-N-cyclopropyl-3-fluoropyridine-4-carboxamide
CID 115646013
5-bromo-N-(cyclohexylmethyl)-N-cyclopropyl-2-fluorobenzamide
CID 60956316
2-cyclohexyl-1-(4-fluorophenyl)ethanone
CID 12505091
N-cyclopropyl-4-fluoro-N-[4-(2-hydroxyethyl)cyclohexyl]benzamide
CID 24966475

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide?
The IUPAC name of N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide (CID 61053717) is N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide.
What is the SMILES notation for N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide?
The canonical SMILES for N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide is O=C(c1ccc(F)cc1)N(CC1CCCCC1)C1CC1.
What is the InChIKey of N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide?
The InChIKey is KWINYRABWACTDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22FNO/c18-15-8-6-14(7-9-15)17(20)19(16-10-11-16)12-13-4-2-1-3-5-13/h6-9,13,16H,1-5,10-12H2.
What are the key properties of N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide?
N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide has a molecular weight of 275.37 g/mol, XLogP of 4.01, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-N-cyclopropyl-4-fluorobenzamide is sourced from PubChem (CID 61053717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).