N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide

C13H26N2O3 — CID 65242526

IUPACN-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide
SMILESCNC1(CC(=O)NCC(O)COC)CCCCC1
InChIInChI=1S/C13H26N2O3/c1-14-13(6-4-3-5-7-13)8-12(17)15-9-11(16)10-18-2/h11,14,16H,3-10H2,1-2H3,(H,15,17)
InChIKeyCBKVKKAWZAMVCM-UHFFFAOYSA-N
MW258.36 g/mol
LogP0.42
Rot. Bonds7

About N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide

N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide (PubChem CID 65242526) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide
PubChem CID65242526
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC NameN-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide
SMILESCNC1(CC(=O)NCC(O)COC)CCCCC1
InChIInChI=1S/C13H26N2O3/c1-14-13(6-4-3-5-7-13)8-12(17)15-9-11(16)10-18-2/h11,14,16H,3-10H2,1-2H3,(H,15,17)
InChIKeyCBKVKKAWZAMVCM-UHFFFAOYSA-N
XLogP0.42
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 50.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2R)-2-hydroxypropyl]-2-[1-(methylamino)cyclohexyl]acetamide
CID 107220990
N-(3-ethyl-2-hydroxypentyl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 106286627
N-ethyl-2-[1-(methylamino)cyclohexyl]acetamide
CID 65240911
N-(4-hydroxy-2-methylbutyl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 66090208
N-(2-aminoethyl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 65242364
N-(2-hydroxy-3-methoxypropyl)-2-propan-2-yloxyacetamide
CID 112703011
methyl 2-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]propanoate
CID 65242652
N-(2-hydroxy-3-methoxypropyl)butanamide
CID 20700886
N-[1-(hydroxymethyl)cyclopentyl]-2-[1-(methylamino)cyclohexyl]acetamide
CID 65242231
3-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]propanoic acid
CID 65242262
N-(3-hydroxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 65240439
2-[1-(methylamino)cyclohexyl]-N-(2-methylprop-2-enyl)acetamide
CID 114617178

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide?
The IUPAC name of N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide (CID 65242526) is N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide.
What is the SMILES notation for N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide?
The canonical SMILES for N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide is CNC1(CC(=O)NCC(O)COC)CCCCC1.
What is the InChIKey of N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide?
The InChIKey is CBKVKKAWZAMVCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-14-13(6-4-3-5-7-13)8-12(17)15-9-11(16)10-18-2/h11,14,16H,3-10H2,1-2H3,(H,15,17).
What are the key properties of N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide?
N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide has a molecular weight of 258.36 g/mol, XLogP of 0.42, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-methoxypropyl)-2-[1-(methylamino)cyclohexyl]acetamide is sourced from PubChem (CID 65242526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).