N-cyclohexyl-4-iodo-N-methylbenzamide

C14H18INO — CID 30383969

IUPACN-cyclohexyl-4-iodo-N-methylbenzamide
SMILESCN(C(=O)c1ccc(I)cc1)C1CCCCC1
InChIInChI=1S/C14H18INO/c1-16(13-5-3-2-4-6-13)14(17)11-7-9-12(15)10-8-11/h7-10,13H,2-6H2,1H3
InChIKeyJHSSPBBVBBVAJK-UHFFFAOYSA-N
MW343.21 g/mol
LogP3.70
Rot. Bonds2

About N-cyclohexyl-4-iodo-N-methylbenzamide

N-cyclohexyl-4-iodo-N-methylbenzamide (PubChem CID 30383969) has the molecular formula C14H18INO and a molecular weight of 343.21 g/mol. Its IUPAC name is N-cyclohexyl-4-iodo-N-methylbenzamide.

Molecular Properties

Compound NameN-cyclohexyl-4-iodo-N-methylbenzamide
PubChem CID30383969
Molecular FormulaC14H18INO
Molecular Weight343.21 g/mol
Exact Mass343.04
IUPAC NameN-cyclohexyl-4-iodo-N-methylbenzamide
SMILESCN(C(=O)c1ccc(I)cc1)C1CCCCC1
InChIInChI=1S/C14H18INO/c1-16(13-5-3-2-4-6-13)14(17)11-7-9-12(15)10-8-11/h7-10,13H,2-6H2,1H3
InChIKeyJHSSPBBVBBVAJK-UHFFFAOYSA-N
XLogP3.70
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.21
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-4-hydroxy-N-methylbenzamide
CID 43176625
N-(azetidin-3-yl)-4-iodo-N-methylbenzamide
CID 66186385
3-chloro-N-cycloheptyl-4-iodo-N-methylbenzamide
CID 103221242
3-chloro-N-cyclobutyl-4-iodo-N-methylbenzamide
CID 103737051
N-cycloheptyl-N-methyl-4-(trifluoromethylsulfanyl)benzamide
CID 55468966
N-cycloheptyl-N-methyl-4-(trifluoromethoxy)benzamide
CID 55469129
N-cycloheptyl-4-(difluoromethylsulfanyl)-N-methylbenzamide
CID 55505149
N-cyclopropyl-4-hydroxy-N-methylbenzamide
CID 43265196
4-(benzenesulfonamido)-N-cyclohexyl-N-methylbenzamide
CID 28567343
N-cyclopentyl-N-methyl-4-(piperidin-1-ylmethyl)benzamide
CID 46772901
N-cyclohexyl-4-fluoro-N-methyl-3-sulfanylbenzamide
CID 107020889
3-chloro-N-cycloheptyl-4-hydroxy-N-methylbenzamide
CID 43409239

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-iodo-N-methylbenzamide?
The IUPAC name of N-cyclohexyl-4-iodo-N-methylbenzamide (CID 30383969) is N-cyclohexyl-4-iodo-N-methylbenzamide.
What is the SMILES notation for N-cyclohexyl-4-iodo-N-methylbenzamide?
The canonical SMILES for N-cyclohexyl-4-iodo-N-methylbenzamide is CN(C(=O)c1ccc(I)cc1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-4-iodo-N-methylbenzamide?
The InChIKey is JHSSPBBVBBVAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18INO/c1-16(13-5-3-2-4-6-13)14(17)11-7-9-12(15)10-8-11/h7-10,13H,2-6H2,1H3.
What are the key properties of N-cyclohexyl-4-iodo-N-methylbenzamide?
N-cyclohexyl-4-iodo-N-methylbenzamide has a molecular weight of 343.21 g/mol, XLogP of 3.70, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-iodo-N-methylbenzamide is sourced from PubChem (CID 30383969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).