N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine

C14H15NOS — CID 90458441

IUPACN-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine
SMILESCOc1ccccc1CC/N=C/c1cccs1
InChIInChI=1S/C14H15NOS/c1-16-14-7-3-2-5-12(14)8-9-15-11-13-6-4-10-17-13/h2-7,10-11H,8-9H2,1H3/b15-11+
InChIKeyFGMWEWSJFHCMQP-RVDMUPIBSA-N
MW245.35 g/mol
LogP3.42
Rot. Bonds5

About N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine

N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine (PubChem CID 90458441) has the molecular formula C14H15NOS and a molecular weight of 245.35 g/mol. Its IUPAC name is N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine.

Molecular Properties

Compound NameN-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine
PubChem CID90458441
Molecular FormulaC14H15NOS
Molecular Weight245.35 g/mol
Exact Mass245.09
IUPAC NameN-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine
SMILESCOc1ccccc1CC/N=C/c1cccs1
InChIInChI=1S/C14H15NOS/c1-16-14-7-3-2-5-12(14)8-9-15-11-13-6-4-10-17-13/h2-7,10-11H,8-9H2,1H3/b15-11+
InChIKeyFGMWEWSJFHCMQP-RVDMUPIBSA-N
XLogP3.42
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2-methoxyphenyl)ethyl]-2-[(E)-thiophen-2-ylmethylideneamino]oxyacetamide
CID 134042819
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CID 110298527
3-[2-(2-methoxyphenyl)ethyliminomethyl]-1H-indol-2-ol
CID 2859778
2-(2-methoxyphenyl)ethanamine;hydrochloride
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ethane;1-methoxy-2-[3-(2-methoxyphenyl)propyl]benzene
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CID 90457832
2-(2-methoxyanilino)-N-(thiophen-2-ylmethylideneamino)propanamide
CID 5003080
2-(2-methoxyphenyl)-1-thiophen-2-ylethanol
CID 61087312
N'-[2-(2-methoxyphenyl)ethyl]propanimidamide
CID 106262572
1-methoxy-2-[2-[2-(2-methoxyphenyl)ethyldisulfanyl]ethyl]benzene
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2-[2-(2-methoxyphenyl)ethyl]phenol
CID 10775715
4-[2-(2-methoxyphenyl)ethyl]thiophene-2-carbaldehyde
CID 154403201

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine?
The IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine (CID 90458441) is N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine.
What is the SMILES notation for N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine?
The canonical SMILES for N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine is COc1ccccc1CC/N=C/c1cccs1.
What is the InChIKey of N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine?
The InChIKey is FGMWEWSJFHCMQP-RVDMUPIBSA-N. The full InChI is InChI=1S/C14H15NOS/c1-16-14-7-3-2-5-12(14)8-9-15-11-13-6-4-10-17-13/h2-7,10-11H,8-9H2,1H3/b15-11+.
What are the key properties of N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine?
N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine has a molecular weight of 245.35 g/mol, XLogP of 3.42, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenyl)ethyl]-1-thiophen-2-ylmethanimine is sourced from PubChem (CID 90458441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).