N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine

C15H26N2OS — CID 79669333

IUPACN-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine
SMILESCCCNC(c1csc(C)c1)C1CN(CC)CCO1
InChIInChI=1S/C15H26N2OS/c1-4-6-16-15(13-9-12(3)19-11-13)14-10-17(5-2)7-8-18-14/h9,11,14-16H,4-8,10H2,1-3H3
InChIKeyIUJSLQRDZGPWOP-UHFFFAOYSA-N
MW282.45 g/mol
LogP2.82
Rot. Bonds6

About N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine

N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine (PubChem CID 79669333) has the molecular formula C15H26N2OS and a molecular weight of 282.45 g/mol. Its IUPAC name is N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine
PubChem CID79669333
Molecular FormulaC15H26N2OS
Molecular Weight282.45 g/mol
Exact Mass282.18
IUPAC NameN-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine
SMILESCCCNC(c1csc(C)c1)C1CN(CC)CCO1
InChIInChI=1S/C15H26N2OS/c1-4-6-16-15(13-9-12(3)19-11-13)14-10-17(5-2)7-8-18-14/h9,11,14-16H,4-8,10H2,1-3H3
InChIKeyIUJSLQRDZGPWOP-UHFFFAOYSA-N
XLogP2.82
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.45
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-methylthiophen-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine
CID 79663833
N-[(5-methylthiophen-3-yl)-(oxolan-2-yl)methyl]propan-1-amine
CID 65328877
N-[(2,6-difluorophenyl)-(4-ethylmorpholin-2-yl)methyl]propan-1-amine
CID 79662548
N-[(4-ethylmorpholin-2-yl)-(1-methylimidazol-2-yl)methyl]propan-1-amine
CID 79668962
N-[(4-ethylmorpholin-2-yl)-(furan-3-yl)methyl]ethanamine
CID 79669655
N-[(3,5-dimethylphenyl)-(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 79093560
N-[(4-bromothiophen-3-yl)-(4-propylmorpholin-2-yl)methyl]propan-1-amine
CID 79676101
N-[(3-fluoro-5-methylphenyl)-(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 79703912
N-[cyclooctyl-(5-methylthiophen-3-yl)methyl]propan-1-amine
CID 80609279
N-[(2-methylcyclopentyl)-(5-methylthiophen-3-yl)methyl]propan-1-amine
CID 107189268
N-[1-(4-ethylmorpholin-2-yl)-2-(4-fluorophenyl)ethyl]propan-1-amine
CID 79665908
1-(4-ethylmorpholin-2-yl)-N-propylprop-2-yn-1-amine
CID 79669262

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine?
The IUPAC name of N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine (CID 79669333) is N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine?
The canonical SMILES for N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine is CCCNC(c1csc(C)c1)C1CN(CC)CCO1.
What is the InChIKey of N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine?
The InChIKey is IUJSLQRDZGPWOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2OS/c1-4-6-16-15(13-9-12(3)19-11-13)14-10-17(5-2)7-8-18-14/h9,11,14-16H,4-8,10H2,1-3H3.
What are the key properties of N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine?
N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine has a molecular weight of 282.45 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylmorpholin-2-yl)-(5-methylthiophen-3-yl)methyl]propan-1-amine is sourced from PubChem (CID 79669333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).