2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide

C10H18INO — CID 64786622

IUPAC2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(N(C)C(=O)CI)CC1
InChIInChI=1S/C10H18INO/c1-8-3-5-9(6-4-8)12(2)10(13)7-11/h8-9H,3-7H2,1-2H3
InChIKeyMYVMPJMCWGOAIA-UHFFFAOYSA-N
MW295.16 g/mol
LogP2.46
Rot. Bonds2

About 2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide

2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide (PubChem CID 64786622) has the molecular formula C10H18INO and a molecular weight of 295.16 g/mol. Its IUPAC name is 2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide
PubChem CID64786622
Molecular FormulaC10H18INO
Molecular Weight295.16 g/mol
Exact Mass295.04
IUPAC Name2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(N(C)C(=O)CI)CC1
InChIInChI=1S/C10H18INO/c1-8-3-5-9(6-4-8)12(2)10(13)7-11/h8-9H,3-7H2,1-2H3
InChIKeyMYVMPJMCWGOAIA-UHFFFAOYSA-N
XLogP2.46
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.16
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-N-(4-methylcyclohexyl)-3-oxobutanamide
CID 18073230
3-chloro-N-methyl-N-(4-methylcyclohexyl)propanamide
CID 43346623
N-cyclopropyl-N-methyl-2-[(4-methylcyclohexyl)methylamino]acetamide
CID 55173315
2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-methyl-N-(4-methylcyclohexyl)acetamide
CID 78963930
2-(cyclopropylmethylamino)-N-methyl-N-(4-methylcyclohexyl)acetamide;hydrochloride
CID 119689921
2-[2-hydroxypropyl(methyl)amino]-N-methyl-N-(4-methylcyclohexyl)acetamide
CID 55060589
2-(3,5-dimethylpiperazin-1-yl)-N-methyl-N-(4-methylcyclohexyl)acetamide;hydrochloride
CID 119924043
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-methyl-N-(4-methylcyclohexyl)acetamide
CID 79607861
5-amino-N,4-dimethyl-N-(4-methylcyclohexyl)pentanamide
CID 82011588
N-methyl-N-(4-methylcyclohexyl)-2-[methyl(pyrrolidin-3-yl)amino]acetamide
CID 63301471
N-methyl-N-(4-methylcyclohexyl)-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride
CID 119912963
2-[5-hydroxypentyl(methyl)amino]-N-methyl-N-(4-methylcyclohexyl)acetamide
CID 107203823

Frequently Asked Questions

What is the IUPAC name of 2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide?
The IUPAC name of 2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide (CID 64786622) is 2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide?
The canonical SMILES for 2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide is CC1CCC(N(C)C(=O)CI)CC1.
What is the InChIKey of 2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide?
The InChIKey is MYVMPJMCWGOAIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18INO/c1-8-3-5-9(6-4-8)12(2)10(13)7-11/h8-9H,3-7H2,1-2H3.
What are the key properties of 2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide?
2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide has a molecular weight of 295.16 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodo-N-methyl-N-(4-methylcyclohexyl)acetamide is sourced from PubChem (CID 64786622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).