5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol

C16H33NO2 — CID 79855744

IUPAC5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol
SMILESCCC(CC)N(CCOC)CC1CCC(C)(C)C1O
InChIInChI=1S/C16H33NO2/c1-6-14(7-2)17(10-11-19-5)12-13-8-9-16(3,4)15(13)18/h13-15,18H,6-12H2,1-5H3
InChIKeyXEDPCKKRAZHVIY-UHFFFAOYSA-N
MW271.44 g/mol
LogP2.92
Rot. Bonds8

About 5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol

5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol (PubChem CID 79855744) has the molecular formula C16H33NO2 and a molecular weight of 271.44 g/mol. Its IUPAC name is 5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol.

Molecular Properties

Compound Name5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol
PubChem CID79855744
Molecular FormulaC16H33NO2
Molecular Weight271.44 g/mol
Exact Mass271.25
IUPAC Name5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol
SMILESCCC(CC)N(CCOC)CC1CCC(C)(C)C1O
InChIInChI=1S/C16H33NO2/c1-6-14(7-2)17(10-11-19-5)12-13-8-9-16(3,4)15(13)18/h13-15,18H,6-12H2,1-5H3
InChIKeyXEDPCKKRAZHVIY-UHFFFAOYSA-N
XLogP2.92
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.44
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol with MolForge

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Related Compounds

2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]cyclohexan-1-ol
CID 62611466
2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-4-methylcyclohexan-1-ol
CID 62611467
5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol
CID 79856473
5-[[2-methoxyethyl(1-methoxypropan-2-yl)amino]methyl]-2,2-dimethylcyclopentan-1-amine
CID 79855167
5-[[2-methoxyethyl(propan-2-yl)amino]methyl]-2,2-dimethylcyclopentan-1-amine
CID 82952605
2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-N-methylcycloheptan-1-amine
CID 62611410
N-(2-methoxyethyl)-N-(piperidin-4-ylmethyl)pentan-3-amine
CID 55002492
2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 63493385
2,2-dimethyl-5-[[methyl(2-methylbutyl)amino]methyl]cyclopentan-1-ol
CID 79855584
5-[cyclopropyl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol
CID 79857606
5-[[cyclopentyl(ethyl)amino]methyl]-2,2-dimethylcyclopentan-1-ol
CID 79855967
5-[[cyclopropyl(propyl)amino]methyl]-2,2-dimethylcyclopentan-1-ol
CID 79855583

Frequently Asked Questions

What is the IUPAC name of 5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol?
The IUPAC name of 5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol (CID 79855744) is 5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol.
What is the SMILES notation for 5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol?
The canonical SMILES for 5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol is CCC(CC)N(CCOC)CC1CCC(C)(C)C1O.
What is the InChIKey of 5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol?
The InChIKey is XEDPCKKRAZHVIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO2/c1-6-14(7-2)17(10-11-19-5)12-13-8-9-16(3,4)15(13)18/h13-15,18H,6-12H2,1-5H3.
What are the key properties of 5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol?
5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol has a molecular weight of 271.44 g/mol, XLogP of 2.92, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol is sourced from PubChem (CID 79855744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).