N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide

C17H25NO2 — CID 55468950

IUPACN-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)N(C)C1CCCCCC1
InChIInChI=1S/C17H25NO2/c1-14-9-7-8-12-16(14)20-13-17(19)18(2)15-10-5-3-4-6-11-15/h7-9,12,15H,3-6,10-11,13H2,1-2H3
InChIKeyVATCJAAOWMRXHL-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.56
Rot. Bonds4

About N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide

N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide (PubChem CID 55468950) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide
PubChem CID55468950
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)N(C)C1CCCCCC1
InChIInChI=1S/C17H25NO2/c1-14-9-7-8-12-16(14)20-13-17(19)18(2)15-10-5-3-4-6-11-15/h7-9,12,15H,3-6,10-11,13H2,1-2H3
InChIKeyVATCJAAOWMRXHL-UHFFFAOYSA-N
XLogP3.56
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-2-(2-methoxyphenoxy)-N-methylacetamide
CID 19169782
2-[2-[cyclohexyl(methyl)amino]-2-oxoethoxy]benzoic acid
CID 43214278
2-(2-chlorophenoxy)-N-cyclopentyl-N-methylacetamide
CID 92674739
2-(2-bromo-4-fluorophenoxy)-N-cyclohexyl-N-methylacetamide
CID 112786473
N,N-dicyclohexyl-2-[2-[2-(dicyclohexylamino)-2-oxoethoxy]phenoxy]acetamide
CID 162174733
N-(cyclopropylmethyl)-N-methyl-2-(2-methylphenoxy)acetamide
CID 94158151
N-cyclopropyl-2-(2,5-dimethylphenoxy)-N-methylacetamide
CID 113222109
ethyl 2-[cyclopropyl-[2-(2-methylphenoxy)acetyl]amino]acetate
CID 61410246
N-cyclohexyl-2-(4-formylphenoxy)-N-methylacetamide
CID 23410696
N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide
CID 717645
2-(4-chlorophenoxy)-N-cycloheptyl-N-methylacetamide
CID 55468954
2-(4-bromophenoxy)-N-cyclohexyl-N-methylacetamide
CID 46771197

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide (CID 55468950) is N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide is Cc1ccccc1OCC(=O)N(C)C1CCCCCC1.
What is the InChIKey of N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide?
The InChIKey is VATCJAAOWMRXHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-14-9-7-8-12-16(14)20-13-17(19)18(2)15-10-5-3-4-6-11-15/h7-9,12,15H,3-6,10-11,13H2,1-2H3.
What are the key properties of N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide?
N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide has a molecular weight of 275.39 g/mol, XLogP of 3.56, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 55468950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).