N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine

C11H18N2O2S — CID 53273822

IUPACN-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine
SMILESCOCc1ccc(CNN2CCOCC2)s1
InChIInChI=1S/C11H18N2O2S/c1-14-9-11-3-2-10(16-11)8-12-13-4-6-15-7-5-13/h2-3,12H,4-9H2,1H3
InChIKeyUELAEPXLADOBQK-UHFFFAOYSA-N
MW242.34 g/mol
LogP1.23
Rot. Bonds5

About N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine

N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine (PubChem CID 53273822) has the molecular formula C11H18N2O2S and a molecular weight of 242.34 g/mol. Its IUPAC name is N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine.

Molecular Properties

Compound NameN-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine
PubChem CID53273822
Molecular FormulaC11H18N2O2S
Molecular Weight242.34 g/mol
Exact Mass242.11
IUPAC NameN-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine
SMILESCOCc1ccc(CNN2CCOCC2)s1
InChIInChI=1S/C11H18N2O2S/c1-14-9-11-3-2-10(16-11)8-12-13-4-6-15-7-5-13/h2-3,12H,4-9H2,1H3
InChIKeyUELAEPXLADOBQK-UHFFFAOYSA-N
XLogP1.23
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.34
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine?
The IUPAC name of N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine (CID 53273822) is N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine.
What is the SMILES notation for N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine?
The canonical SMILES for N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine is COCc1ccc(CNN2CCOCC2)s1.
What is the InChIKey of N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine?
The InChIKey is UELAEPXLADOBQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S/c1-14-9-11-3-2-10(16-11)8-12-13-4-6-15-7-5-13/h2-3,12H,4-9H2,1H3.
What are the key properties of N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine?
N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine has a molecular weight of 242.34 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(methoxymethyl)thiophen-2-yl]methyl]morpholin-4-amine is sourced from PubChem (CID 53273822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).