2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide

C13H26N2O2 — CID 106236541

IUPAC2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide
SMILESCC(C)C1CCC(NCCOCC(N)=O)CC1
InChIInChI=1S/C13H26N2O2/c1-10(2)11-3-5-12(6-4-11)15-7-8-17-9-13(14)16/h10-12,15H,3-9H2,1-2H3,(H2,14,16)
InChIKeyGACZCIMVLBFBAC-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.29
Rot. Bonds7

About 2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide

2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide (PubChem CID 106236541) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide
PubChem CID106236541
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide
SMILESCC(C)C1CCC(NCCOCC(N)=O)CC1
InChIInChI=1S/C13H26N2O2/c1-10(2)11-3-5-12(6-4-11)15-7-8-17-9-13(14)16/h10-12,15H,3-9H2,1-2H3,(H2,14,16)
InChIKeyGACZCIMVLBFBAC-UHFFFAOYSA-N
XLogP1.29
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.29
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-[(4-methylcycloheptyl)amino]ethoxy]acetamide
CID 106235412
2-[2-[(4,4-dimethylcyclohexyl)amino]ethoxy]acetamide
CID 106235196
2-[2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]ethoxy]acetamide
CID 106235673
N-(2-butoxyethyl)-4-propan-2-ylcycloheptan-1-amine
CID 65091022
2-[2-(1,4-dioxaspiro[4.5]decan-8-ylamino)ethoxy]acetamide
CID 114162148
2-[2-[(1,1-dioxothiolan-3-yl)amino]ethoxy]acetamide
CID 106236546
tert-butyl 3-[2-(2-amino-2-oxoethoxy)ethylamino]pyrrolidine-1-carboxylate
CID 106235434
ethyl 3-[2-(2-amino-2-oxoethoxy)ethylamino]cyclohexane-1-carboxylate
CID 106235025
2-[2-[(2-ethyloxan-4-yl)amino]ethoxy]acetamide
CID 106236551
2-[2-(cyclohex-2-en-1-ylamino)ethoxy]acetamide
CID 106238210
2-[2-[1-(oxolan-3-yl)ethylamino]ethoxy]acetamide
CID 106235023
2-[2-(2-amino-2-oxoethoxy)ethylamino]-N-cyclopropylacetamide
CID 106237778

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide?
The IUPAC name of 2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide (CID 106236541) is 2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide is CC(C)C1CCC(NCCOCC(N)=O)CC1.
What is the InChIKey of 2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide?
The InChIKey is GACZCIMVLBFBAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-10(2)11-3-5-12(6-4-11)15-7-8-17-9-13(14)16/h10-12,15H,3-9H2,1-2H3,(H2,14,16).
What are the key properties of 2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide?
2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide has a molecular weight of 242.36 g/mol, XLogP of 1.29, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(4-propan-2-ylcyclohexyl)amino]ethoxy]acetamide is sourced from PubChem (CID 106236541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).