N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine

C15H27N3OS — CID 79824727

IUPACN-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1nccs1)C1CN(CCC)CCO1
InChIInChI=1S/C15H27N3OS/c1-3-5-16-13(11-15-17-6-10-20-15)14-12-18(7-4-2)8-9-19-14/h6,10,13-14,16H,3-5,7-9,11-12H2,1-2H3
InChIKeySCDQWILSHZXWBU-UHFFFAOYSA-N
MW297.47 g/mol
LogP2.16
Rot. Bonds8

About N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine

N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine (PubChem CID 79824727) has the molecular formula C15H27N3OS and a molecular weight of 297.47 g/mol. Its IUPAC name is N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
PubChem CID79824727
Molecular FormulaC15H27N3OS
Molecular Weight297.47 g/mol
Exact Mass297.19
IUPAC NameN-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1nccs1)C1CN(CCC)CCO1
InChIInChI=1S/C15H27N3OS/c1-3-5-16-13(11-15-17-6-10-20-15)14-12-18(7-4-2)8-9-19-14/h6,10,13-14,16H,3-5,7-9,11-12H2,1-2H3
InChIKeySCDQWILSHZXWBU-UHFFFAOYSA-N
XLogP2.16
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.47
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-1-(4-ethylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
CID 79824289
N-[2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propylmorpholin-2-yl)ethyl]propan-1-amine
CID 79664430
N-propyl-1-(4-propylmorpholin-2-yl)-3-thiophen-2-ylpropan-1-amine
CID 79664239
N-[2-(1-methyltriazol-4-yl)-1-(4-propylmorpholin-2-yl)ethyl]propan-1-amine
CID 107050193
N-[2-(5-chlorothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]propan-1-amine
CID 79664444
[1-(4-methylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105244511
N-ethyl-1-(4-propylmorpholin-2-yl)-2-thiophen-2-ylethanamine
CID 79657789
2-(4-bromothiophen-2-yl)-N-ethyl-1-(4-propylmorpholin-2-yl)ethanamine
CID 79658332
N-ethyl-1-(4-propylmorpholin-2-yl)-2-thiophen-3-ylethanamine
CID 79657173
3-[2-(4-ethylmorpholin-2-yl)-2-(propylamino)ethyl]pyridin-2-amine
CID 79662549
N-[1-cyclopentyl-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
CID 79825132
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethanamine
CID 79664229

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine?
The IUPAC name of N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine (CID 79824727) is N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine is CCCNC(Cc1nccs1)C1CN(CCC)CCO1.
What is the InChIKey of N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine?
The InChIKey is SCDQWILSHZXWBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3OS/c1-3-5-16-13(11-15-17-6-10-20-15)14-12-18(7-4-2)8-9-19-14/h6,10,13-14,16H,3-5,7-9,11-12H2,1-2H3.
What are the key properties of N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine?
N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine has a molecular weight of 297.47 g/mol, XLogP of 2.16, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-propylmorpholin-2-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine is sourced from PubChem (CID 79824727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).