[4-(methoxymethyl)thiophen-2-yl]methanamine

C7H11NOS — CID 55212073

IUPAC[4-(methoxymethyl)thiophen-2-yl]methanamine
SMILESCOCc1csc(CN)c1
InChIInChI=1S/C7H11NOS/c1-9-4-6-2-7(3-8)10-5-6/h2,5H,3-4,8H2,1H3
InChIKeyNURDYBWXGCIIBN-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.35
Rot. Bonds3

About [4-(methoxymethyl)thiophen-2-yl]methanamine

[4-(methoxymethyl)thiophen-2-yl]methanamine (PubChem CID 55212073) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is [4-(methoxymethyl)thiophen-2-yl]methanamine.

Molecular Properties

Compound Name[4-(methoxymethyl)thiophen-2-yl]methanamine
PubChem CID55212073
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name[4-(methoxymethyl)thiophen-2-yl]methanamine
SMILESCOCc1csc(CN)c1
InChIInChI=1S/C7H11NOS/c1-9-4-6-2-7(3-8)10-5-6/h2,5H,3-4,8H2,1H3
InChIKeyNURDYBWXGCIIBN-UHFFFAOYSA-N
XLogP1.35
TPSA35.25 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 ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(methoxymethyl)thiophen-2-yl]methanamine?
The IUPAC name of [4-(methoxymethyl)thiophen-2-yl]methanamine (CID 55212073) is [4-(methoxymethyl)thiophen-2-yl]methanamine.
What is the SMILES notation for [4-(methoxymethyl)thiophen-2-yl]methanamine?
The canonical SMILES for [4-(methoxymethyl)thiophen-2-yl]methanamine is COCc1csc(CN)c1.
What is the InChIKey of [4-(methoxymethyl)thiophen-2-yl]methanamine?
The InChIKey is NURDYBWXGCIIBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-9-4-6-2-7(3-8)10-5-6/h2,5H,3-4,8H2,1H3.
What are the key properties of [4-(methoxymethyl)thiophen-2-yl]methanamine?
[4-(methoxymethyl)thiophen-2-yl]methanamine has a molecular weight of 157.24 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(methoxymethyl)thiophen-2-yl]methanamine is sourced from PubChem (CID 55212073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).