N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine

C14H24N2OS — CID 79052246

IUPACN-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine
SMILESCCNC(c1cccs1)C(C)(C)N1CCOCC1
InChIInChI=1S/C14H24N2OS/c1-4-15-13(12-6-5-11-18-12)14(2,3)16-7-9-17-10-8-16/h5-6,11,13,15H,4,7-10H2,1-3H3
InChIKeyXFJJHSUEHIXVRD-UHFFFAOYSA-N
MW268.43 g/mol
LogP2.51
Rot. Bonds5

About N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine

N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine (PubChem CID 79052246) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine
PubChem CID79052246
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC NameN-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine
SMILESCCNC(c1cccs1)C(C)(C)N1CCOCC1
InChIInChI=1S/C14H24N2OS/c1-4-15-13(12-6-5-11-18-12)14(2,3)16-7-9-17-10-8-16/h5-6,11,13,15H,4,7-10H2,1-3H3
InChIKeyXFJJHSUEHIXVRD-UHFFFAOYSA-N
XLogP2.51
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine?
The IUPAC name of N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine (CID 79052246) is N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine.
What is the SMILES notation for N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine?
The canonical SMILES for N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine is CCNC(c1cccs1)C(C)(C)N1CCOCC1.
What is the InChIKey of N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine?
The InChIKey is XFJJHSUEHIXVRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-4-15-13(12-6-5-11-18-12)14(2,3)16-7-9-17-10-8-16/h5-6,11,13,15H,4,7-10H2,1-3H3.
What are the key properties of N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine?
N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine has a molecular weight of 268.43 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-2-morpholin-4-yl-1-thiophen-2-ylpropan-1-amine is sourced from PubChem (CID 79052246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).