2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide

C13H26N2O2 — CID 113450228

IUPAC2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide
SMILESCOC(C)(C)CNC(=O)CC1(N)CCCCC1
InChIInChI=1S/C13H26N2O2/c1-12(2,17-3)10-15-11(16)9-13(14)7-5-4-6-8-13/h4-10,14H2,1-3H3,(H,15,16)
InChIKeyGRNFJVZUPZBKOT-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.58
Rot. Bonds5

About 2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide

2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide (PubChem CID 113450228) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide
PubChem CID113450228
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide
SMILESCOC(C)(C)CNC(=O)CC1(N)CCCCC1
InChIInChI=1S/C13H26N2O2/c1-12(2,17-3)10-15-11(16)9-13(14)7-5-4-6-8-13/h4-10,14H2,1-3H3,(H,15,16)
InChIKeyGRNFJVZUPZBKOT-UHFFFAOYSA-N
XLogP1.58
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminocyclohexyl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide
CID 64676879
2-[1-(methylamino)cyclohexyl]-N-[2-(2,2,2-trifluoroethoxy)ethyl]acetamide
CID 65241953
N-[2-(2,2-difluoroethoxy)ethyl]-2-[1-(methylamino)cyclohexyl]acetamide
CID 105910228
2-(1-aminocyclohexyl)-N-[2-(2,2-difluoroethoxy)ethyl]acetamide
CID 105910284
3-cyclohexyl-N-(2-methoxyethyl)propanamide
CID 2299647
2-cyclohexyl-N-(2-methoxyethyl)acetamide
CID 16473206
4-N-(2-methoxyethyl)cyclohexane-1,4-dicarboxamide
CID 68628921
N-(2-methoxyethyl)-2-oxocyclohexane-1-carboxamide
CID 135145205
4-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclohexane-1,4-dicarboxamide
CID 166130881
3-cyclohexyl-N-(1-methoxypropan-2-yl)propanamide
CID 3415767
N-(1-methoxypropan-2-yl)cyclohexanecarboxamide
CID 19916604
1-amino-N-(2-methoxyethyl)cyclohexane-1-carboxamide
CID 24695954

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide?
The IUPAC name of 2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide (CID 113450228) is 2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide.
What is the SMILES notation for 2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide?
The canonical SMILES for 2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide is COC(C)(C)CNC(=O)CC1(N)CCCCC1.
What is the InChIKey of 2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide?
The InChIKey is GRNFJVZUPZBKOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-12(2,17-3)10-15-11(16)9-13(14)7-5-4-6-8-13/h4-10,14H2,1-3H3,(H,15,16).
What are the key properties of 2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide?
2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide has a molecular weight of 242.36 g/mol, XLogP of 1.58, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide is sourced from PubChem (CID 113450228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).