5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine

C11H18N2O — CID 147738193

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

About 5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine

5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine (PubChem CID 147738193) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine.

Molecular Properties

Compound Name5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine
PubChem CID147738193
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine
SMILESCC1=C(N2CCOCC2)C=CC(N)C1
InChIInChI=1S/C11H18N2O/c1-9-8-10(12)2-3-11(9)13-4-6-14-7-5-13/h2-3,10H,4-8,12H2,1H3
InChIKeyGZUGHIGLENDNJM-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

4-(3-Fluoro-2,6-dimethylmorpholin-4-yl)cyclohexa-2,4-dien-1-amine
CID 70892383
5-Fluoro-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine
CID 167074369
5-Methyl-5-morpholin-4-ylcyclohexa-1,3-dien-1-amine
CID 19754038
2-Methylphosphanyl-4-morpholin-4-ylcyclohexa-1,5-dien-1-amine
CID 67208578
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
4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,2-dimethylcyclohexa-2,4-dien-1-amine
CID 70892577
4-(2,6-Dimethylmorpholin-4-yl)cyclohexa-2,4-dien-1-amine
CID 70892610
4-[(2R)-2,6-dimethylmorpholin-4-yl]cyclohexa-2,4-dien-1-amine
CID 70974382
4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]cyclohexa-2,4-dien-1-amine
CID 70974386
4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-5-methylcyclohexa-1,5-dien-1-amine
CID 70974389
4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]cyclohexa-1,5-dien-1-amine
CID 70974397

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine?
The IUPAC name of 5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine (CID 147738193) is 5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine.
What is the SMILES notation for 5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine?
The canonical SMILES for 5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine is CC1=C(N2CCOCC2)C=CC(N)C1.
What is the InChIKey of 5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine?
The InChIKey is GZUGHIGLENDNJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9-8-10(12)2-3-11(9)13-4-6-14-7-5-13/h2-3,10H,4-8,12H2,1H3.
What are the key properties of 5-methyl-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine?
5-methyl-4-morpholin-4-ylcyclohexa-2,4-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-4-morpholin-4-ylcyclohexa-2,4-dien-1-amine is sourced from PubChem (CID 147738193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).