N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide

C17H26N2O2 — CID 43784509

IUPACN-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1cccc(NC(C)C2CCCCC2)c1
InChIInChI=1S/C17H26N2O2/c1-13(14-7-4-3-5-8-14)18-15-9-6-10-16(11-15)19-17(20)12-21-2/h6,9-11,13-14,18H,3-5,7-8,12H2,1-2H3,(H,19,20)
InChIKeyIDJTUZFSUUGAOC-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.65
Rot. Bonds6

About N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide

N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide (PubChem CID 43784509) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide
PubChem CID43784509
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1cccc(NC(C)C2CCCCC2)c1
InChIInChI=1S/C17H26N2O2/c1-13(14-7-4-3-5-8-14)18-15-9-6-10-16(11-15)19-17(20)12-21-2/h6,9-11,13-14,18H,3-5,7-8,12H2,1-2H3,(H,19,20)
InChIKeyIDJTUZFSUUGAOC-UHFFFAOYSA-N
XLogP3.65
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide
CID 43713200
N-[3-[(2-methoxyacetyl)amino]phenyl]cyclohexanecarboxamide
CID 47022982
2-methoxy-N-[3-[[2-[(1R,2R)-2-methylcyclohexyl]oxyacetyl]amino]phenyl]acetamide
CID 96532685
2-methoxy-N-[3-[[2-[(1S,2S)-2-methylcyclohexyl]oxyacetyl]amino]phenyl]acetamide
CID 96532684
2-methoxy-N-[3-[[2-[(1S,2R)-2-methylcyclohexyl]oxyacetyl]amino]phenyl]acetamide
CID 96532683
2-methoxy-N-[3-(2-methylpentan-3-ylamino)phenyl]acetamide
CID 43784507
2-methoxy-N-[3-[(2-methylcyclohexyl)amino]phenyl]acetamide
CID 43713084
2-[[(1S)-1-cyclohexylethyl]amino]-N-(3-methoxyphenyl)acetamide
CID 81388783
[3-(1-cyclopropylethylamino)phenyl]urea
CID 43744613
N-(1-cyclohexylethyl)-3-(2-methoxyethoxymethyl)aniline
CID 60942752
2-[3-(1-cyclopentylethylamino)phenoxy]acetamide
CID 62632459
N-[3-[1-(furan-2-yl)ethylamino]phenyl]-2-methoxyacetamide
CID 43713201

Frequently Asked Questions

What is the IUPAC name of N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide?
The IUPAC name of N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide (CID 43784509) is N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide.
What is the SMILES notation for N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide?
The canonical SMILES for N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide is COCC(=O)Nc1cccc(NC(C)C2CCCCC2)c1.
What is the InChIKey of N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide?
The InChIKey is IDJTUZFSUUGAOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13(14-7-4-3-5-8-14)18-15-9-6-10-16(11-15)19-17(20)12-21-2/h6,9-11,13-14,18H,3-5,7-8,12H2,1-2H3,(H,19,20).
What are the key properties of N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide?
N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide has a molecular weight of 290.41 g/mol, XLogP of 3.65, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide is sourced from PubChem (CID 43784509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).