N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide

C14H28N2O2 — CID 103021566

IUPACN-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide
SMILESCCCN(C(=O)C(C)(C)OC)C1CCC(N)CC1
InChIInChI=1S/C14H28N2O2/c1-5-10-16(13(17)14(2,3)18-4)12-8-6-11(15)7-9-12/h11-12H,5-10,15H2,1-4H3
InChIKeyLIFUNCQZQCKIBE-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.92
Rot. Bonds5

About N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide

N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide (PubChem CID 103021566) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide
PubChem CID103021566
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide
SMILESCCCN(C(=O)C(C)(C)OC)C1CCC(N)CC1
InChIInChI=1S/C14H28N2O2/c1-5-10-16(13(17)14(2,3)18-4)12-8-6-11(15)7-9-12/h11-12H,5-10,15H2,1-4H3
InChIKeyLIFUNCQZQCKIBE-UHFFFAOYSA-N
XLogP1.92
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

rac-2-methoxy-N-[(1r,4r)-4-aminocyclohexyl]acetamide hydrochloride
CID 86277382
N-(4-aminocyclohexyl)-2-methoxyacetamide
CID 61279804
N-cyclohexyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 13049545
N-cyclohexyl-2-methoxypropanamide
CID 85942385
[1-(Cyclohexylamino)-2-methyl-1-oxopropan-2-yl] acetate
CID 11218422
2-methoxy-2-methyl-N-(1-methylpiperidin-4-yl)propanamide
CID 54300614
N-(1,1-dimethylpiperidin-1-ium-4-yl)-2-methoxy-2-methylpropanamide
CID 54360194
tert-Butyl (1R*,4R*)-4-(2-methoxyacetamido)cyclohexylcarbamate
CID 86277407
1-(4-Aminopiperidin-1-yl)-2-methoxy-2-methylpropan-1-one
CID 103017125
N-(3-aminocyclohexyl)-2-methoxypropanamide
CID 120471867
N-[(1R,2R)-2-aminocyclohexyl]-2-methoxy-N-methylacetamide
CID 141279795
1-(4-Aminopiperidin-1-yl)-2-methyl-2-propan-2-yloxypropan-1-one
CID 175623193

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide?
The IUPAC name of N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide (CID 103021566) is N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide?
The canonical SMILES for N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide is CCCN(C(=O)C(C)(C)OC)C1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide?
The InChIKey is LIFUNCQZQCKIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-5-10-16(13(17)14(2,3)18-4)12-8-6-11(15)7-9-12/h11-12H,5-10,15H2,1-4H3.
What are the key properties of N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide?
N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide has a molecular weight of 256.39 g/mol, XLogP of 1.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-methoxy-2-methyl-N-propylpropanamide is sourced from PubChem (CID 103021566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).