[4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine

C17H34N2O — CID 43544398

IUPAC[4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine
SMILESCC1CN(C2(CN)CCC(C(C)(C)C)CC2)C(C)CO1
InChIInChI=1S/C17H34N2O/c1-13-11-20-14(2)10-19(13)17(12-18)8-6-15(7-9-17)16(3,4)5/h13-15H,6-12,18H2,1-5H3
InChIKeyCUJCMBJUEKEIOW-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.03
Rot. Bonds2

About [4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine

[4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine (PubChem CID 43544398) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is [4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine
PubChem CID43544398
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name[4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine
SMILESCC1CN(C2(CN)CCC(C(C)(C)C)CC2)C(C)CO1
InChIInChI=1S/C17H34N2O/c1-13-11-20-14(2)10-19(13)17(12-18)8-6-15(7-9-17)16(3,4)5/h13-15H,6-12,18H2,1-5H3
InChIKeyCUJCMBJUEKEIOW-UHFFFAOYSA-N
XLogP3.03
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(2,5-dimethylmorpholin-4-yl)cyclopropyl]methanamine
CID 106661059
[1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine
CID 43544407
[1-(2,5-dimethylmorpholin-4-yl)-3,5-dimethylcyclohexyl]methanamine
CID 64753038
[1-(2,6-dimethylmorpholin-4-yl)-4-(2-methylbutan-2-yl)cyclohexyl]methanamine
CID 43080101
[4-tert-butyl-1-(2,3-dimethylpiperidin-1-yl)cycloheptyl]methanamine
CID 65090041
[4-tert-butyl-1-(3-methylpiperidin-1-yl)cyclohexyl]methanamine
CID 43079349
[4-tert-butyl-1-(3,4-dimethylpiperazin-1-yl)cycloheptyl]methanamine
CID 65089417
[4-(2-methylbutan-2-yl)-1-(2-methylpiperidin-1-yl)cyclohexyl]methanamine
CID 43080296
[1-ethyl-4-(5-ethyl-2-methylmorpholin-4-yl)piperidin-4-yl]methanamine
CID 61424029
(4-tert-butyl-1-thiomorpholin-4-ylcyclohexyl)methanamine
CID 29033800
[1-(2,5-dimethylmorpholin-4-yl)-2,4,4-trimethylcyclopentyl]methanamine
CID 106662992
[4-tert-butyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine
CID 43584372

Frequently Asked Questions

What is the IUPAC name of [4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine?
The IUPAC name of [4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine (CID 43544398) is [4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine.
What is the SMILES notation for [4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine?
The canonical SMILES for [4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine is CC1CN(C2(CN)CCC(C(C)(C)C)CC2)C(C)CO1.
What is the InChIKey of [4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine?
The InChIKey is CUJCMBJUEKEIOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-13-11-20-14(2)10-19(13)17(12-18)8-6-15(7-9-17)16(3,4)5/h13-15H,6-12,18H2,1-5H3.
What are the key properties of [4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine?
[4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine has a molecular weight of 282.47 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-tert-butyl-1-(2,5-dimethylmorpholin-4-yl)cyclohexyl]methanamine is sourced from PubChem (CID 43544398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).