4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine

C11H19NO — CID 118198411

IUPAC4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine
SMILESCC1C=CC(CN2CCOCC2)C1
InChIInChI=1S/C11H19NO/c1-10-2-3-11(8-10)9-12-4-6-13-7-5-12/h2-3,10-11H,4-9H2,1H3
InChIKeyZPTPNLIFVGVWQG-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.53
Rot. Bonds2

About 4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine

4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine (PubChem CID 118198411) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine
PubChem CID118198411
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine
SMILESCC1C=CC(CN2CCOCC2)C1
InChIInChI=1S/C11H19NO/c1-10-2-3-11(8-10)9-12-4-6-13-7-5-12/h2-3,10-11H,4-9H2,1H3
InChIKeyZPTPNLIFVGVWQG-UHFFFAOYSA-N
XLogP1.53
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1S,4R)-4-(morpholin-4-ylmethyl)cyclopent-2-en-1-amine
CID 66858310
4-[(2-methylcyclobutyl)methyl]morpholine
CID 67036054
4-(oxan-4-ylmethyl)morpholine
CID 122244931
3-(morpholin-4-ylmethyl)cyclobutan-1-ol
CID 68619351
4-[(4-methylpiperidin-2-yl)methyl]morpholine
CID 114421101
4-[(4-methylpiperidin-1-yl)methyl]morpholine
CID 155208667
4-(azetidin-3-ylmethyl)morpholine
CID 66596271
4-(cyclohexylmethyl)morpholine
CID 641545
4-[(1-ethylpiperidin-4-yl)methyl]morpholine;propane
CID 176563536
4-(morpholin-4-ylmethyl)morpholine
CID 21839
3-(morpholin-4-ylmethyl)cyclopentane-1-carboxylic acid
CID 83821302
4-[[(1R,2S,3R)-2-methyl-3-(2-pyrazol-1-ylethyl)cyclobutyl]methyl]morpholine
CID 70306839

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine?
The IUPAC name of 4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine (CID 118198411) is 4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine.
What is the SMILES notation for 4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine?
The canonical SMILES for 4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine is CC1C=CC(CN2CCOCC2)C1.
What is the InChIKey of 4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine?
The InChIKey is ZPTPNLIFVGVWQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-10-2-3-11(8-10)9-12-4-6-13-7-5-12/h2-3,10-11H,4-9H2,1H3.
What are the key properties of 4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine?
4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine has a molecular weight of 181.28 g/mol, XLogP of 1.53, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine is sourced from PubChem (CID 118198411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).