4-(2-methylbuta-2,3-dienyl)morpholine

C9H15NO — CID 14891012

IUPAC4-(2-methylbuta-2,3-dienyl)morpholine
SMILESC=C=C(C)CN1CCOCC1
InChIInChI=1S/C9H15NO/c1-3-9(2)8-10-4-6-11-7-5-10/h1,4-8H2,2H3
InChIKeyLISGJLKSURUUQK-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.05
Rot. Bonds2

About 4-(2-methylbuta-2,3-dienyl)morpholine

4-(2-methylbuta-2,3-dienyl)morpholine (PubChem CID 14891012) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 4-(2-methylbuta-2,3-dienyl)morpholine.

Molecular Properties

Compound Name4-(2-methylbuta-2,3-dienyl)morpholine
PubChem CID14891012
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name4-(2-methylbuta-2,3-dienyl)morpholine
SMILESC=C=C(C)CN1CCOCC1
InChIInChI=1S/C9H15NO/c1-3-9(2)8-10-4-6-11-7-5-10/h1,4-8H2,2H3
InChIKeyLISGJLKSURUUQK-UHFFFAOYSA-N
XLogP1.05
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(2-methylbuta-2,3-dienyl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-3-morpholin-4-ylprop-1-en-1-one
CID 87850524
1-morpholin-4-ylpropan-2-one;hydrochloride
CID 67491798
(E)-N-[(E)-[2,2-dimethyl-3-(morpholin-4-ylmethyl)penta-3,4-dienylidene]amino]-2,2-dimethyl-3-(morpholin-4-ylmethyl)penta-3,4-dien-1-imine
CID 11362000
N-[2,2-dimethyl-3-(morpholin-4-ylmethyl)penta-3,4-dienylidene]hydroxylamine
CID 131865481
1,3-dimorpholin-4-ylpropan-2-one
CID 139559066
methyl 2-morpholin-4-ylacetate
CID 1268178
trifluoro(3-morpholin-4-ylprop-1-en-2-yl)boranuide
CID 56655901
4-[2-(pyrrolidin-1-ylmethyl)but-2-enyl]morpholine
CID 70026725
1-[4-(3-morpholin-4-ylprop-1-en-2-yl)phenyl]ethanone
CID 11507029
ethane;4-[(3Z)-6-methyl-2-methylidenehepta-3,5-dienyl]morpholine
CID 143021023
3-methyl-4-morpholin-4-ylbut-2-enoic acid;hydrochloride
CID 134690671
(E)-1-morpholin-4-ylpent-3-en-2-one
CID 146386174

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylbuta-2,3-dienyl)morpholine?
The IUPAC name of 4-(2-methylbuta-2,3-dienyl)morpholine (CID 14891012) is 4-(2-methylbuta-2,3-dienyl)morpholine.
What is the SMILES notation for 4-(2-methylbuta-2,3-dienyl)morpholine?
The canonical SMILES for 4-(2-methylbuta-2,3-dienyl)morpholine is C=C=C(C)CN1CCOCC1.
What is the InChIKey of 4-(2-methylbuta-2,3-dienyl)morpholine?
The InChIKey is LISGJLKSURUUQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-3-9(2)8-10-4-6-11-7-5-10/h1,4-8H2,2H3.
What are the key properties of 4-(2-methylbuta-2,3-dienyl)morpholine?
4-(2-methylbuta-2,3-dienyl)morpholine has a molecular weight of 153.22 g/mol, XLogP of 1.05, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylbuta-2,3-dienyl)morpholine is sourced from PubChem (CID 14891012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).