4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol

C15H29NO2 — CID 115239955

IUPAC4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol
SMILESCN(CCC1CCOCC1)CC1CCC(O)CC1
InChIInChI=1S/C15H29NO2/c1-16(9-6-13-7-10-18-11-8-13)12-14-2-4-15(17)5-3-14/h13-15,17H,2-12H2,1H3
InChIKeyCJPDCOKXXHKXKO-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.29
Rot. Bonds5

About 4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol

4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol (PubChem CID 115239955) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol
PubChem CID115239955
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol
SMILESCN(CCC1CCOCC1)CC1CCC(O)CC1
InChIInChI=1S/C15H29NO2/c1-16(9-6-13-7-10-18-11-8-13)12-14-2-4-15(17)5-3-14/h13-15,17H,2-12H2,1H3
InChIKeyCJPDCOKXXHKXKO-UHFFFAOYSA-N
XLogP2.29
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol with MolForge

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Related Compounds

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-methyl-N-(oxan-4-ylmethyl)ethanamine
CID 79615063
4-[[3,3-dimethylbutyl(methyl)amino]methyl]cyclohexan-1-ol
CID 115239935
N-methyl-2-(oxan-4-yl)-N-(piperidin-3-ylmethyl)ethanamine
CID 115209752
N-(2-chloroethyl)-N-methyl-2-(oxan-4-yl)ethanamine
CID 115215246
1-[methyl-[2-(oxan-4-yl)ethyl]amino]propan-2-one
CID 115235227
1-amino-2-methyl-4-[methyl(oxan-4-ylmethyl)amino]butan-2-ol
CID 64819145
4-(oxan-4-ylmethyl)cyclohexan-1-ol
CID 116928530
N'-hydroxy-3-[methyl(oxan-4-ylmethyl)amino]propanimidamide
CID 76942668
N-(bromomethyl)-N-methyl-1-(oxan-4-yl)methanamine
CID 115262142
[1-amino-2-[2-[methyl(oxan-4-ylmethyl)amino]ethyl]cyclopentyl]methanol
CID 79571201
methyl 2-methyl-2-(methylamino)-4-[methyl(oxan-4-ylmethyl)amino]butanoate
CID 63711102
2-methyl-2-(methylamino)-5-[methyl(oxan-4-ylmethyl)amino]pentanoic acid
CID 63711272

Frequently Asked Questions

What is the IUPAC name of 4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol (CID 115239955) is 4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol is CN(CCC1CCOCC1)CC1CCC(O)CC1.
What is the InChIKey of 4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol?
The InChIKey is CJPDCOKXXHKXKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-16(9-6-13-7-10-18-11-8-13)12-14-2-4-15(17)5-3-14/h13-15,17H,2-12H2,1H3.
What are the key properties of 4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol?
4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol has a molecular weight of 255.40 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 115239955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).