2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine

C14H27NO — CID 104538088

IUPAC2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCCC(NCCC2CCOC2)C1C
InChIInChI=1S/C14H27NO/c1-11-4-3-5-14(12(11)2)15-8-6-13-7-9-16-10-13/h11-15H,3-10H2,1-2H3
InChIKeyFDHCRYMTEZPUDQ-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.83
Rot. Bonds4

About 2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine

2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine (PubChem CID 104538088) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine
PubChem CID104538088
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCCC(NCCC2CCOC2)C1C
InChIInChI=1S/C14H27NO/c1-11-4-3-5-14(12(11)2)15-8-6-13-7-9-16-10-13/h11-15H,3-10H2,1-2H3
InChIKeyFDHCRYMTEZPUDQ-UHFFFAOYSA-N
XLogP2.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(oxolan-3-yl)ethyl]cyclohexanamine
CID 103878945
3-[(2,3-dimethylcyclohexyl)amino]propan-1-ol
CID 60672378
N-(cyclobutylmethyl)-2-(oxolan-3-yl)ethanamine
CID 102671743
2,2-dimethyl-N-[2-(oxolan-3-yl)ethyl]-1,3-dioxan-5-amine
CID 102673023
N'-(2,3-dimethylcyclohexyl)methanediamine
CID 143582027
N-[2-(oxolan-3-yl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 113424537
2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine
CID 62384942
2,3-dimethyl-N-(2-propoxyethyl)cyclohexan-1-amine
CID 106451456
2-[2-[(2,3-dimethylcyclohexyl)amino]ethyl]propanedinitrile
CID 175600999
methyl 3-[(2,3-dimethylcyclohexyl)amino]propanoate
CID 43242623
3-(oxolan-3-yl)-N-propan-2-ylpropan-1-amine
CID 64503037
3-methyl-N-[2-(oxolan-3-yl)ethyl]butan-2-amine
CID 104537978

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine (CID 104538088) is 2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine is CC1CCCC(NCCC2CCOC2)C1C.
What is the InChIKey of 2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine?
The InChIKey is FDHCRYMTEZPUDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-11-4-3-5-14(12(11)2)15-8-6-13-7-9-16-10-13/h11-15H,3-10H2,1-2H3.
What are the key properties of 2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine?
2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[2-(oxolan-3-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 104538088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).