N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide

C14H28N2O2 — CID 114459191

IUPACN-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide
SMILESCOCCN(CCN)C(=O)CC1CCCCCC1
InChIInChI=1S/C14H28N2O2/c1-18-11-10-16(9-8-15)14(17)12-13-6-4-2-3-5-7-13/h13H,2-12,15H2,1H3
InChIKeyJBUIJBQALQOGEZ-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.78
Rot. Bonds7

About N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide

N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide (PubChem CID 114459191) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide
PubChem CID114459191
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide
SMILESCOCCN(CCN)C(=O)CC1CCCCCC1
InChIInChI=1S/C14H28N2O2/c1-18-11-10-16(9-8-15)14(17)12-13-6-4-2-3-5-7-13/h13H,2-12,15H2,1H3
InChIKeyJBUIJBQALQOGEZ-UHFFFAOYSA-N
XLogP1.78
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-N-(2-methoxyethyl)-2-(oxan-2-yl)acetamide
CID 113468413
N-(3-aminopropyl)-2-cycloheptyl-N-propylacetamide
CID 114456956
N-benzyl-2-cyclopentyl-N-(2-methoxyethyl)acetamide
CID 86975819
N-(2-aminoethyl)-2-cyclohexyl-N-(2-phenylethyl)acetamide
CID 120886160
3-cyclopentyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)propanamide
CID 113339851
N-(3-aminopropyl)-N-(2-methoxyethyl)cycloheptanecarboxamide
CID 63287770
N-(3-amino-3-sulfanylidenepropyl)-N-(2-methoxyethyl)-2-(thian-4-yl)acetamide
CID 83137721
N-(3-aminopropyl)-2-cycloheptyl-N-methylacetamide
CID 115737510
N-(2-aminoethyl)-N-(2-methoxyethyl)azepane-1-carboxamide
CID 113468421
N-(2-aminoethyl)-N-(2-methoxyethyl)-2-methylcyclopentane-1-carboxamide
CID 107184722
N,N-dibutyl-2-cyclopentylacetamide
CID 13315634
N-(2-methoxyethyl)-2-piperidin-3-yl-N-prop-2-enylacetamide
CID 103338928

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide?
The IUPAC name of N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide (CID 114459191) is N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide?
The canonical SMILES for N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide is COCCN(CCN)C(=O)CC1CCCCCC1.
What is the InChIKey of N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide?
The InChIKey is JBUIJBQALQOGEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-18-11-10-16(9-8-15)14(17)12-13-6-4-2-3-5-7-13/h13H,2-12,15H2,1H3.
What are the key properties of N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide?
N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide has a molecular weight of 256.39 g/mol, XLogP of 1.78, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-cycloheptyl-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 114459191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).