2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide

C16H31N3O4 — CID 43067877

IUPAC2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(CC(=O)NCCOC)C1CCCCC1
InChIInChI=1S/C16H31N3O4/c1-22-10-8-17-15(20)12-19(14-6-4-3-5-7-14)13-16(21)18-9-11-23-2/h14H,3-13H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyWOPNFWOKYKSBHC-UHFFFAOYSA-N
MW329.44 g/mol
LogP0.15
Rot. Bonds11

About 2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide

2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide (PubChem CID 43067877) has the molecular formula C16H31N3O4 and a molecular weight of 329.44 g/mol. Its IUPAC name is 2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide
PubChem CID43067877
Molecular FormulaC16H31N3O4
Molecular Weight329.44 g/mol
Exact Mass329.23
IUPAC Name2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(CC(=O)NCCOC)C1CCCCC1
InChIInChI=1S/C16H31N3O4/c1-22-10-8-17-15(20)12-19(14-6-4-3-5-7-14)13-16(21)18-9-11-23-2/h14H,3-13H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyWOPNFWOKYKSBHC-UHFFFAOYSA-N
XLogP0.15
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide
CID 62016627
2-[acetyl(cyclohexyl)amino]-N-(2-methoxyethyl)acetamide
CID 113159416
2-[2-aminoethyl(cyclobutyl)amino]-N-(2-methoxyethyl)acetamide
CID 102875295
2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide
CID 113148836
2-[acetyl(cyclohexyl)amino]-N-(3-methoxypropyl)acetamide
CID 113159417
2-[cyclobutyl(3-hydroxypropyl)amino]-N-(3-methoxypropyl)acetamide
CID 102848725
methyl 2-[cyclopentyl-[2-(ethylamino)-2-oxoethyl]amino]acetate
CID 80710178
2-[(2-aminocycloheptyl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 54989285
2-[(1,1-dioxothiolan-3-yl)-[2-(2-methoxyethylamino)-2-oxoethyl]amino]acetic acid
CID 60838544
N-(3-cyclohexyloxypropyl)-2-[cyclopentyl(ethyl)amino]acetamide
CID 87017395
2-[(3-aminocyclopentyl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 79468067
2-[cyclopentyl-[2-(ethylamino)-2-oxoethyl]amino]acetic acid
CID 60833171

Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide (CID 43067877) is 2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CN(CC(=O)NCCOC)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide?
The InChIKey is WOPNFWOKYKSBHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O4/c1-22-10-8-17-15(20)12-19(14-6-4-3-5-7-14)13-16(21)18-9-11-23-2/h14H,3-13H2,1-2H3,(H,17,20)(H,18,21).
What are the key properties of 2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide?
2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide has a molecular weight of 329.44 g/mol, XLogP of 0.15, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 43067877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).