2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine

C8H18N6O — CID 70023781

IUPAC2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine
SMILESNCCN1CCOCC1.Nc1ncn[nH]1
InChIInChI=1S/C6H14N2O.C2H4N4/c7-1-2-8-3-5-9-6-4-8;3-2-4-1-5-6-2/h1-7H2;1H,(H3,3,4,5,6)
InChIKeyOBOXVEMXMCFVOP-UHFFFAOYSA-N
MW214.27 g/mol
LogP-1.34
Rot. Bonds2

About 2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine

2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine (PubChem CID 70023781) has the molecular formula C8H18N6O and a molecular weight of 214.27 g/mol. Its IUPAC name is 2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine.

Molecular Properties

Compound Name2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine
PubChem CID70023781
Molecular FormulaC8H18N6O
Molecular Weight214.27 g/mol
Exact Mass214.15
IUPAC Name2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine
SMILESNCCN1CCOCC1.Nc1ncn[nH]1
InChIInChI=1S/C6H14N2O.C2H4N4/c7-1-2-8-3-5-9-6-4-8;3-2-4-1-5-6-2/h1-7H2;1H,(H3,3,4,5,6)
InChIKeyOBOXVEMXMCFVOP-UHFFFAOYSA-N
XLogP-1.34
TPSA106.08 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 5-1.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

5-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 154327108
2-(4-methylpiperazin-1-yl)ethanamine;2-morpholin-4-ylethanamine;2-piperidin-1-ylethanamine
CID 162033952
acetamide;2-morpholin-4-ylethanamine
CID 158022700
6-(2-morpholin-4-ylethyl)pyrimidin-4-amine
CID 83916654
2-morpholin-4-yl-N-(1H-1,2,4-triazol-5-yl)acetamide
CID 18873860
2-[4-(morpholin-4-ylmethyl)imidazol-1-yl]ethanamine
CID 107500617
2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamine;dihydrochloride
CID 46736988
4-N-(3-morpholin-4-ylpropyl)-1H-pyrazole-4,5-diamine
CID 114987621
2-[1-(2-morpholin-4-ylethyl)pyrrol-2-yl]ethanamine
CID 83823084
7-morpholin-4-ylheptan-1-amine
CID 28596900
2-(aziridin-1-yl)ethanamine;dichloronickel
CID 15821369
4-[4-(2-morpholin-4-ylethyl)phenyl]-1H-pyrazol-5-amine
CID 117433925

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine?
The IUPAC name of 2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine (CID 70023781) is 2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine.
What is the SMILES notation for 2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine?
The canonical SMILES for 2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine is NCCN1CCOCC1.Nc1ncn[nH]1.
What is the InChIKey of 2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine?
The InChIKey is OBOXVEMXMCFVOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O.C2H4N4/c7-1-2-8-3-5-9-6-4-8;3-2-4-1-5-6-2/h1-7H2;1H,(H3,3,4,5,6).
What are the key properties of 2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine?
2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine has a molecular weight of 214.27 g/mol, XLogP of -1.34, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylethanamine;1H-1,2,4-triazol-5-amine is sourced from PubChem (CID 70023781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).