2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine

C16H32N2O — CID 79829478

IUPAC2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine
SMILESCCCNC1C(N2CCOCC2C)CCCC1(C)C
InChIInChI=1S/C16H32N2O/c1-5-9-17-15-14(7-6-8-16(15,3)4)18-10-11-19-12-13(18)2/h13-15,17H,5-12H2,1-4H3
InChIKeyTZVMSHWYRAHARS-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.65
Rot. Bonds4

About 2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine

2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine (PubChem CID 79829478) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine
PubChem CID79829478
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine
SMILESCCCNC1C(N2CCOCC2C)CCCC1(C)C
InChIInChI=1S/C16H32N2O/c1-5-9-17-15-14(7-6-8-16(15,3)4)18-10-11-19-12-13(18)2/h13-15,17H,5-12H2,1-4H3
InChIKeyTZVMSHWYRAHARS-UHFFFAOYSA-N
XLogP2.65
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-N-propyl-6-(2-propylpiperidin-1-yl)cyclohexan-1-amine
CID 83053137
6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 104958323
5-(3,3-dimethylmorpholin-4-yl)-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79859729
2,2-dimethyl-N-propyl-6-(4-propylpiperazin-1-yl)cyclohexan-1-amine
CID 79835810
1-[3,3-dimethyl-2-(propylamino)cyclohexyl]-N,N-dimethylpiperidin-4-amine
CID 79835828
2,2-dimethyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylcyclohexan-1-amine
CID 79835826
6-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79927085
5-(azocan-1-yl)-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79865020
N,2,2-trimethyl-6-(2-methylazepan-1-yl)cyclohexan-1-amine
CID 79829283
2,2-dimethyl-5-(morpholin-4-ylmethyl)-N-propylcyclopentan-1-amine
CID 79866931
N,2,2-trimethyl-6-[(3-methylmorpholin-4-yl)methyl]cyclohexan-1-amine
CID 79853010
3-(3-methylmorpholin-4-yl)-1-(propylamino)cyclohexane-1-carboxylic acid
CID 79636456

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine?
The IUPAC name of 2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine (CID 79829478) is 2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine.
What is the SMILES notation for 2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine?
The canonical SMILES for 2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine is CCCNC1C(N2CCOCC2C)CCCC1(C)C.
What is the InChIKey of 2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine?
The InChIKey is TZVMSHWYRAHARS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-5-9-17-15-14(7-6-8-16(15,3)4)18-10-11-19-12-13(18)2/h13-15,17H,5-12H2,1-4H3.
What are the key properties of 2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine?
2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine has a molecular weight of 268.44 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-(3-methylmorpholin-4-yl)-N-propylcyclohexan-1-amine is sourced from PubChem (CID 79829478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).