N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine

C11H18N2O — CID 145000877

IUPACN-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine
SMILESCNC1=CCC(N2CCOCC2)C=C1
InChIInChI=1S/C11H18N2O/c1-12-10-2-4-11(5-3-10)13-6-8-14-9-7-13/h2-4,11-12H,5-9H2,1H3
InChIKeyBISUWBLLUZZDLB-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.75
Rot. Bonds2

About N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine

N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine (PubChem CID 145000877) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine.

Molecular Properties

Compound NameN-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine
PubChem CID145000877
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC NameN-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine
SMILESCNC1=CCC(N2CCOCC2)C=C1
InChIInChI=1S/C11H18N2O/c1-12-10-2-4-11(5-3-10)13-6-8-14-9-7-13/h2-4,11-12H,5-9H2,1H3
InChIKeyBISUWBLLUZZDLB-UHFFFAOYSA-N
XLogP0.75
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[[4-(methylamino)cyclohexa-2,4-dien-1-yl]amino]-morpholin-4-ylmethanol
CID 142969707
4-[4-[(1S,5R)-3-ethyl-3-azabicyclo[3.1.0]hexan-1-yl]cyclohexa-2,4-dien-1-yl]morpholine
CID 70814121
4-[4-(3-benzyl-3-azabicyclo[3.1.0]hexan-1-yl)cyclohexa-2,4-dien-1-yl]morpholine
CID 70814071
4-(4-aminocyclohexa-2,4-dien-1-yl)morpholin-3-one
CID 163965647
4-cyclopropylmorpholine;ethane
CID 155594914
4-morpholin-4-ylcyclopent-2-ene-1-carboxylic acid
CID 79688030
4-[(6aS,9R,10aR)-6a,9,10,10a-tetrahydro-6H-benzo[c]chromen-9-yl]morpholine
CID 10956622
trimethyl-(6-morpholin-4-ylcyclohexen-1-yl)silane
CID 15416145
3-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-ol
CID 174762674
N-methyl-2H-pyran-4-amine
CID 69002805
N-methyl-5-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 175634186
4-[4-[2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazol-4-yl]cyclohexa-2,4-dien-1-yl]morpholine
CID 70865265

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine?
The IUPAC name of N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine (CID 145000877) is N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine.
What is the SMILES notation for N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine?
The canonical SMILES for N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine is CNC1=CCC(N2CCOCC2)C=C1.
What is the InChIKey of N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine?
The InChIKey is BISUWBLLUZZDLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-12-10-2-4-11(5-3-10)13-6-8-14-9-7-13/h2-4,11-12H,5-9H2,1H3.
What are the key properties of N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine?
N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine has a molecular weight of 194.28 g/mol, XLogP of 0.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine is sourced from PubChem (CID 145000877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).