1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine

C10H18N4OS — CID 115906891

IUPAC1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine
SMILESCCN1CCOC(CNCc2csnn2)C1
InChIInChI=1S/C10H18N4OS/c1-2-14-3-4-15-10(7-14)6-11-5-9-8-16-13-12-9/h8,10-11H,2-7H2,1H3
InChIKeyCPTSLWUMRYXPKZ-UHFFFAOYSA-N
MW242.35 g/mol
LogP0.35
Rot. Bonds5

About 1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine

1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine (PubChem CID 115906891) has the molecular formula C10H18N4OS and a molecular weight of 242.35 g/mol. Its IUPAC name is 1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine
PubChem CID115906891
Molecular FormulaC10H18N4OS
Molecular Weight242.35 g/mol
Exact Mass242.12
IUPAC Name1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine
SMILESCCN1CCOC(CNCc2csnn2)C1
InChIInChI=1S/C10H18N4OS/c1-2-14-3-4-15-10(7-14)6-11-5-9-8-16-13-12-9/h8,10-11H,2-7H2,1H3
InChIKeyCPTSLWUMRYXPKZ-UHFFFAOYSA-N
XLogP0.35
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.35
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine?
The IUPAC name of 1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine (CID 115906891) is 1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine.
What is the SMILES notation for 1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine?
The canonical SMILES for 1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine is CCN1CCOC(CNCc2csnn2)C1.
What is the InChIKey of 1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine?
The InChIKey is CPTSLWUMRYXPKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4OS/c1-2-14-3-4-15-10(7-14)6-11-5-9-8-16-13-12-9/h8,10-11H,2-7H2,1H3.
What are the key properties of 1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine?
1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine has a molecular weight of 242.35 g/mol, XLogP of 0.35, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylmorpholin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine is sourced from PubChem (CID 115906891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).