N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide

C14H28N2O2 — CID 3226695

IUPACN-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide
SMILESCCOCCCNCC(=O)NCC1CCCCC1
InChIInChI=1S/C14H28N2O2/c1-2-18-10-6-9-15-12-14(17)16-11-13-7-4-3-5-8-13/h13,15H,2-12H2,1H3,(H,16,17)
InChIKeyOEVNSAORIDXNNM-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.70
Rot. Bonds9

About N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide

N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide (PubChem CID 3226695) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide
PubChem CID3226695
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide
SMILESCCOCCCNCC(=O)NCC1CCCCC1
InChIInChI=1S/C14H28N2O2/c1-2-18-10-6-9-15-12-14(17)16-11-13-7-4-3-5-8-13/h13,15H,2-12H2,1H3,(H,16,17)
InChIKeyOEVNSAORIDXNNM-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-cyclohexylethylamino)-N-(3-methoxypropyl)acetamide
CID 54957148
4-ethoxy-N-[(3-hydroxycyclohexyl)methyl]butanamide
CID 103690736
2-(3-butoxypropylamino)-N-cycloheptylacetamide
CID 115571481
N-butyl-2-(2-cyclohexylethylamino)acetamide
CID 60976119
N-ethyl-2-(3-propoxypropylamino)acetamide
CID 82943813
N-(cyclohexylmethyl)-2-(prop-2-enylamino)acetamide
CID 78908843
2-(2-ethoxyethylamino)-N-(3-methoxypropyl)acetamide
CID 61486039
N-[(4-ethylcyclohexyl)methyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119743684
2-(3-aminocyclohexyl)-N-(3-ethoxypropyl)acetamide
CID 62783140
3-ethoxy-N-[(1-methylpiperidin-4-yl)methyl]propan-1-amine
CID 62655051
N-[(3-chlorocyclobutyl)methyl]-3-ethoxypropan-1-amine
CID 66004138
2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide
CID 60672261

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide?
The IUPAC name of N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide (CID 3226695) is N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide.
What is the SMILES notation for N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide?
The canonical SMILES for N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide is CCOCCCNCC(=O)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide?
The InChIKey is OEVNSAORIDXNNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-2-18-10-6-9-15-12-14(17)16-11-13-7-4-3-5-8-13/h13,15H,2-12H2,1H3,(H,16,17).
What are the key properties of N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide?
N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide has a molecular weight of 256.39 g/mol, XLogP of 1.70, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide is sourced from PubChem (CID 3226695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).