[4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine

C9H15N3OS — CID 164645566

IUPAC[4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine
SMILESCN1CCOC(CN)C1c1ccns1
InChIInChI=1S/C9H15N3OS/c1-12-4-5-13-7(6-10)9(12)8-2-3-11-14-8/h2-3,7,9H,4-6,10H2,1H3
InChIKeyIUTJWSGIGMWFOJ-UHFFFAOYSA-N
MW213.31 g/mol
LogP0.47
Rot. Bonds2

About [4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine

[4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine (PubChem CID 164645566) has the molecular formula C9H15N3OS and a molecular weight of 213.31 g/mol. Its IUPAC name is [4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine
PubChem CID164645566
Molecular FormulaC9H15N3OS
Molecular Weight213.31 g/mol
Exact Mass213.09
IUPAC Name[4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine
SMILESCN1CCOC(CN)C1c1ccns1
InChIInChI=1S/C9H15N3OS/c1-12-4-5-13-7(6-10)9(12)8-2-3-11-14-8/h2-3,7,9H,4-6,10H2,1H3
InChIKeyIUTJWSGIGMWFOJ-UHFFFAOYSA-N
XLogP0.47
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.31
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(1,4-oxathian-2-yl)-1-(1,2-thiazol-5-yl)methanamine
CID 131036684
1-(1,4-dioxan-2-yl)-N-methyl-1-(1,2-thiazol-5-yl)methanamine
CID 131062605
N-[[4-[2-(1,2-thiazol-5-yl)ethyl]morpholin-2-yl]methyl]acetamide
CID 146138433
9-(1,2-Thiazol-5-yl)-2,5-dioxa-8-azaspiro[3.5]nonane
CID 165587754
9-Methyl-5-(1,2-thiazol-5-yl)-1-oxa-4-azaspiro[5.5]undecane
CID 165588650
9-(1,2-Thiazol-5-yl)-5-oxa-8-azaspiro[3.5]nonane
CID 165591922
5-(1,2-Thiazol-5-yl)-1-oxa-4-azaspiro[5.5]undecane
CID 165592323
5-(1,2-Thiazol-5-yl)-1-oxa-4-azaspiro[5.7]tridecane
CID 165592443
2-Methyl-10-(1,2-thiazol-5-yl)-6-oxa-2,9-diazaspiro[4.5]decane
CID 165595813
9-Methyl-5-(1,2-thiazol-5-yl)-1-oxa-4-azaspiro[5.6]dodecane
CID 165597302
2,2-Dimethyl-9-(1,2-thiazol-5-yl)-5-oxa-8-azaspiro[3.5]nonane
CID 165601673
10-(1,2-Thiazol-5-yl)-6-oxa-9-azaspiro[4.5]decane
CID 165603585

Frequently Asked Questions

What is the IUPAC name of [4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine?
The IUPAC name of [4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine (CID 164645566) is [4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine.
What is the SMILES notation for [4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine?
The canonical SMILES for [4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine is CN1CCOC(CN)C1c1ccns1.
What is the InChIKey of [4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine?
The InChIKey is IUTJWSGIGMWFOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3OS/c1-12-4-5-13-7(6-10)9(12)8-2-3-11-14-8/h2-3,7,9H,4-6,10H2,1H3.
What are the key properties of [4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine?
[4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine has a molecular weight of 213.31 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-3-(1,2-thiazol-5-yl)morpholin-2-yl]methanamine is sourced from PubChem (CID 164645566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).