5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine

C11H18N2O — CID 19754038

IUPAC5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine
SMILESCC1(N2CCOCC2)C=CC=C(N)C1
InChIInChI=1S/C11H18N2O/c1-11(4-2-3-10(12)9-11)13-5-7-14-8-6-13/h2-4H,5-9,12H2,1H3
InChIKeyYWMXEGDCSHJTJW-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.88
Rot. Bonds1

About 5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine

5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine (PubChem CID 19754038) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine.

Molecular Properties

Compound Name5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine
PubChem CID19754038
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine
SMILESCC1(N2CCOCC2)C=CC=C(N)C1
InChIInChI=1S/C11H18N2O/c1-11(4-2-3-10(12)9-11)13-5-7-14-8-6-13/h2-4H,5-9,12H2,1H3
InChIKeyYWMXEGDCSHJTJW-UHFFFAOYSA-N
XLogP0.88
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-Dimethyl-4-morpholin-4-yl-1,3-dihydropyridine-6-thione
CID 4212035
4-(1-methoxy-2,2,6,6-tetramethyl-3H-pyridin-4-yl)morpholine
CID 68104291
4-(2,6-Dimethylmorpholin-4-yl)-6-fluoro-5-methylcyclohexa-1,3-dien-1-amine
CID 70974453
4-Methyl-4-morpholin-4-yl-3-(trifluoromethyl)cyclohexa-1,5-dien-1-amine
CID 141342997
6-Fluoro-1-methyl-4-(morpholin-4-ylmethyl)cyclohexa-2,4-dien-1-amine
CID 162439986
4-(5,5-Dimethylcyclohexa-1,3-dien-1-yl)morpholine
CID 21854280
4-(2,2,6,6-Tetramethyl-1,2,3,6-tetrahydropyridin-4-yl)morpholine
CID 12418552
4-(6-Methylcyclohexa-1,3-dien-1-yl)morpholine
CID 68381389
4-(3-Methylcyclohexa-1,5-dien-1-yl)morpholine
CID 69344068
1-N-(2-ethoxyethyl)-4-methylcyclohexa-1,5-diene-1,4-diamine
CID 69905513
N-ethyl-2-(2-morpholin-4-ylethyl)cyclohexa-1,3-dien-1-amine
CID 70333386
N-methyl-1-(6-methyl-3-morpholin-4-ylcyclohexa-2,4-dien-1-yl)methanamine
CID 70863713

Frequently Asked Questions

What is the IUPAC name of 5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine?
The IUPAC name of 5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine (CID 19754038) is 5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine.
What is the SMILES notation for 5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine?
The canonical SMILES for 5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine is CC1(N2CCOCC2)C=CC=C(N)C1.
What is the InChIKey of 5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine?
The InChIKey is YWMXEGDCSHJTJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-11(4-2-3-10(12)9-11)13-5-7-14-8-6-13/h2-4H,5-9,12H2,1H3.
What are the key properties of 5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine?
5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine has a molecular weight of 194.28 g/mol, XLogP of 0.88, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine is sourced from PubChem (CID 19754038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).