2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one

C10H14N2O2 — CID 139390465

IUPAC2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one
SMILESNC1=CC=CC(N2CCOCC2)C1=O
InChIInChI=1S/C10H14N2O2/c11-8-2-1-3-9(10(8)13)12-4-6-14-7-5-12/h1-3,9H,4-7,11H2
InChIKeyDXZUCCXWLWGHKJ-UHFFFAOYSA-N
MW194.23 g/mol
LogP-0.33
Rot. Bonds1

About 2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one

2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one (PubChem CID 139390465) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one.

Molecular Properties

Compound Name2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one
PubChem CID139390465
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one
SMILESNC1=CC=CC(N2CCOCC2)C1=O
InChIInChI=1S/C10H14N2O2/c11-8-2-1-3-9(10(8)13)12-4-6-14-7-5-12/h1-3,9H,4-7,11H2
InChIKeyDXZUCCXWLWGHKJ-UHFFFAOYSA-N
XLogP-0.33
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3Z,5Z)-3-amino-7-morpholin-4-ylocta-3,5,7-trien-2-one
CID 129215893
4-Morpholin-4-ylcyclohexa-2,4-dien-1-one
CID 141267365
6-Morpholin-4-ylcyclohexa-2,4-dien-1-one
CID 141431317
(6S)-6-(2-methylpropylamino)-3-morpholin-4-ylcyclohexa-2,4-dien-1-one
CID 141437296
3-Morpholin-4-ylcyclohexa-3,5-diene-1,2-dione
CID 160852428
5-Morpholin-4-ylcyclohexa-2,4-dien-1-one
CID 176029708
4-(Morpholin-4-yl)cyclohexa-3,5-diene-1,2-dione
CID 71368713
2-Amino-7-(morpholin-4-ylmethyl)cyclohepta-2,4,6-trien-1-one
CID 101864968

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one?
The IUPAC name of 2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one (CID 139390465) is 2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one.
What is the SMILES notation for 2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one?
The canonical SMILES for 2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one is NC1=CC=CC(N2CCOCC2)C1=O.
What is the InChIKey of 2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one?
The InChIKey is DXZUCCXWLWGHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c11-8-2-1-3-9(10(8)13)12-4-6-14-7-5-12/h1-3,9H,4-7,11H2.
What are the key properties of 2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one?
2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one has a molecular weight of 194.23 g/mol, XLogP of -0.33, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-morpholin-4-ylcyclohexa-2,4-dien-1-one is sourced from PubChem (CID 139390465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).