N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide

C13H26N2O2 — CID 54829340

IUPACN-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide
SMILESCOCCCNCC(=O)N(C)C1CCCCC1
InChIInChI=1S/C13H26N2O2/c1-15(12-7-4-3-5-8-12)13(16)11-14-9-6-10-17-2/h12,14H,3-11H2,1-2H3
InChIKeyCKCHBOOEODYDHL-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.40
Rot. Bonds7

About N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide

N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide (PubChem CID 54829340) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide
PubChem CID54829340
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide
SMILESCOCCCNCC(=O)N(C)C1CCCCC1
InChIInChI=1S/C13H26N2O2/c1-15(12-7-4-3-5-8-12)13(16)11-14-9-6-10-17-2/h12,14H,3-11H2,1-2H3
InChIKeyCKCHBOOEODYDHL-UHFFFAOYSA-N
XLogP1.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexyl-2-(3-methoxypropylamino)acetamide
CID 43089974
N-(cyclohexylmethyl)-N-cyclopropyl-2-(2-methoxyethylamino)acetamide
CID 79281659
2-(2-methoxyethylamino)-N-methyl-N-(2-methylcyclohexyl)acetamide
CID 79282069
N-(cyclohexylmethyl)-3-methoxypropan-1-amine
CID 17207140
N-cyclohexyl-2-[2-hydroxyethyl(2-methoxyethyl)amino]-N-methylacetamide
CID 115613753
2-[acetyl(cyclohexyl)amino]-N-(3-methoxypropyl)acetamide
CID 113159417
N-(cyclobutylmethyl)-2-(2-methoxyethylamino)-N-methylacetamide
CID 79282440
2-N-cyclohexyl-1-N-(3-methoxypropyl)-2-N-methylpropane-1,2-diamine
CID 62557645
methyl 4-[cyclohexyl(methyl)amino]-4-oxobutanoate
CID 115174643
N-[(1-benzylpyrrol-2-yl)methyl]-N-cyclohexyl-2-(3-methoxypropylamino)acetamide
CID 42770742
4-[[2-[cyclohexyl(ethyl)amino]-2-oxoethyl]amino]butanoic acid
CID 43473494
N-cyclohexyl-2-[(4-methoxyphenyl)methylamino]-N-methylacetamide
CID 54837999

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide?
The IUPAC name of N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide (CID 54829340) is N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide.
What is the SMILES notation for N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide?
The canonical SMILES for N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide is COCCCNCC(=O)N(C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide?
The InChIKey is CKCHBOOEODYDHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-15(12-7-4-3-5-8-12)13(16)11-14-9-6-10-17-2/h12,14H,3-11H2,1-2H3.
What are the key properties of N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide?
N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide has a molecular weight of 242.36 g/mol, XLogP of 1.40, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(3-methoxypropylamino)-N-methylacetamide is sourced from PubChem (CID 54829340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).