methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium

C7H10NOS+ — CID 145071544

IUPACmethoxy-[(Z)-2-thiophen-2-ylethenyl]azanium
SMILESCO[NH2+]/C=C\c1cccs1
InChIInChI=1S/C7H9NOS/c1-9-8-5-4-7-3-2-6-10-7/h2-6,8H,1H3/p+1/b5-4-
InChIKeyJLWZQULJHDLRKJ-PLNGDYQASA-O
MW156.23 g/mol
LogP0.84
Rot. Bonds3

About methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium

methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium (PubChem CID 145071544) has the molecular formula C7H10NOS+ and a molecular weight of 156.23 g/mol. Its IUPAC name is methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium.

Molecular Properties

Compound Namemethoxy-[(Z)-2-thiophen-2-ylethenyl]azanium
PubChem CID145071544
Molecular FormulaC7H10NOS+
Molecular Weight156.23 g/mol
Exact Mass156.05
IUPAC Namemethoxy-[(Z)-2-thiophen-2-ylethenyl]azanium
SMILESCO[NH2+]/C=C\c1cccs1
InChIInChI=1S/C7H9NOS/c1-9-8-5-4-7-3-2-6-10-7/h2-6,8H,1H3/p+1/b5-4-
InChIKeyJLWZQULJHDLRKJ-PLNGDYQASA-O
XLogP0.84
TPSA25.84 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

CID 687329
CID 687329
CID 95586
CID 95586
CID 1712459
CID 1712459
CID 90679993
CID 90679993
CID 4962250
CID 4962250
CID 145487686
CID 145487686
CID 163676971
CID 163676971
CID 170738704
CID 170738704
CID 15579988
CID 15579988
CID 53424714
CID 53424714
CID 10464400
CID 10464400
CID 13063343
CID 13063343

Frequently Asked Questions

What is the IUPAC name of methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium?
The IUPAC name of methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium (CID 145071544) is methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium.
What is the SMILES notation for methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium?
The canonical SMILES for methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium is CO[NH2+]/C=C\c1cccs1.
What is the InChIKey of methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium?
The InChIKey is JLWZQULJHDLRKJ-PLNGDYQASA-O. The full InChI is InChI=1S/C7H9NOS/c1-9-8-5-4-7-3-2-6-10-7/h2-6,8H,1H3/p+1/b5-4-.
What are the key properties of methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium?
methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium has a molecular weight of 156.23 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-[(Z)-2-thiophen-2-ylethenyl]azanium is sourced from PubChem (CID 145071544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).