1-methoxy-N-methyl-1-thiophen-2-ylmethanamine

C7H11NOS — CID 116961428

IUPAC1-methoxy-N-methyl-1-thiophen-2-ylmethanamine
SMILESCNC(OC)c1cccs1
InChIInChI=1S/C7H11NOS/c1-8-7(9-2)6-4-3-5-10-6/h3-5,7-8H,1-2H3
InChIKeyQRGSGGXSDKXLIA-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.61
Rot. Bonds3

About 1-methoxy-N-methyl-1-thiophen-2-ylmethanamine

1-methoxy-N-methyl-1-thiophen-2-ylmethanamine (PubChem CID 116961428) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 1-methoxy-N-methyl-1-thiophen-2-ylmethanamine.

Molecular Properties

Compound Name1-methoxy-N-methyl-1-thiophen-2-ylmethanamine
PubChem CID116961428
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name1-methoxy-N-methyl-1-thiophen-2-ylmethanamine
SMILESCNC(OC)c1cccs1
InChIInChI=1S/C7H11NOS/c1-8-7(9-2)6-4-3-5-10-6/h3-5,7-8H,1-2H3
InChIKeyQRGSGGXSDKXLIA-UHFFFAOYSA-N
XLogP1.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 1-methoxy-N-methyl-1-thiophen-2-ylmethanamine 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

1-(2-methoxyphenyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 43483471
(1R)-N-methoxy-1-thiophen-2-ylethanamine
CID 124574743
2-propan-2-ylthiophene
CID 178128598
1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 116714360
N-(dithiophen-2-ylmethyl)-2,2-dimethoxyethanamine
CID 60816965
(2S)-2-methoxy-2-thiophen-2-ylethanamine
CID 26722465
methyl 2-thiophen-2-ylpropanoate
CID 12819459
1-(4,5-dimethoxy-2-methylphenyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 43626732
1-(2-chloro-4,5-dimethoxyphenyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 43486329
methyl 2-chloro-2-thiophen-2-ylacetate
CID 60704267
(3S)-3-chloro-N-methyl-3-thiophen-2-ylpropan-1-amine
CID 89397451
N-methyl-2-phenoxy-1-thiophen-2-ylethanamine
CID 62715336

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-methyl-1-thiophen-2-ylmethanamine?
The IUPAC name of 1-methoxy-N-methyl-1-thiophen-2-ylmethanamine (CID 116961428) is 1-methoxy-N-methyl-1-thiophen-2-ylmethanamine.
What is the SMILES notation for 1-methoxy-N-methyl-1-thiophen-2-ylmethanamine?
The canonical SMILES for 1-methoxy-N-methyl-1-thiophen-2-ylmethanamine is CNC(OC)c1cccs1.
What is the InChIKey of 1-methoxy-N-methyl-1-thiophen-2-ylmethanamine?
The InChIKey is QRGSGGXSDKXLIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-8-7(9-2)6-4-3-5-10-6/h3-5,7-8H,1-2H3.
What are the key properties of 1-methoxy-N-methyl-1-thiophen-2-ylmethanamine?
1-methoxy-N-methyl-1-thiophen-2-ylmethanamine has a molecular weight of 157.24 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-methyl-1-thiophen-2-ylmethanamine is sourced from PubChem (CID 116961428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).