N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine

C15H29NO — CID 65166242

IUPACN-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine
SMILESCCNCC1(CCC2CCCO2)CCCCC1
InChIInChI=1S/C15H29NO/c1-2-16-13-15(9-4-3-5-10-15)11-8-14-7-6-12-17-14/h14,16H,2-13H2,1H3
InChIKeyYQGWCWPGXZWHCN-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.51
Rot. Bonds6

About N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine

N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine (PubChem CID 65166242) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine
PubChem CID65166242
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine
SMILESCCNCC1(CCC2CCCO2)CCCCC1
InChIInChI=1S/C15H29NO/c1-2-16-13-15(9-4-3-5-10-15)11-8-14-7-6-12-17-14/h14,16H,2-13H2,1H3
InChIKeyYQGWCWPGXZWHCN-UHFFFAOYSA-N
XLogP3.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]propan-1-amine
CID 65166397
N-[[3-[2-(oxolan-2-yl)ethyl]oxolan-3-yl]methyl]ethanamine
CID 65165659
N-[[1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine
CID 55055994
N-[[4-(2-cyclohexylethyl)oxan-4-yl]methyl]ethanamine
CID 114192526
1-[4-butyl-1-[2-(oxolan-2-yl)ethyl]cyclohexyl]-N-methylmethanamine
CID 65166135
2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine
CID 63129724
1-[2-(oxolan-2-yl)ethyl]cycloheptan-1-ol
CID 65162275
N-[[1-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-ylmethyl)cyclohexyl]methyl]ethanamine
CID 62258681
N-[(1-methylcyclopentyl)methyl]-2-(oxolan-2-yl)ethanamine
CID 65163534
2-[3-[1-(bromomethyl)cyclohexyl]propyl]oxolane
CID 66048020
2-methoxy-N-[[1-(oxolan-2-ylmethyl)cyclohexyl]methyl]ethanamine
CID 55106983
1-[2-(oxolan-2-yl)ethyl]cyclopentan-1-ol
CID 65162273

Frequently Asked Questions

What is the IUPAC name of N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine?
The IUPAC name of N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine (CID 65166242) is N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine.
What is the SMILES notation for N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine?
The canonical SMILES for N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine is CCNCC1(CCC2CCCO2)CCCCC1.
What is the InChIKey of N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine?
The InChIKey is YQGWCWPGXZWHCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-2-16-13-15(9-4-3-5-10-15)11-8-14-7-6-12-17-14/h14,16H,2-13H2,1H3.
What are the key properties of N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine?
N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine has a molecular weight of 239.40 g/mol, XLogP of 3.51, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine is sourced from PubChem (CID 65166242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).