N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine

C10H19N3OS — CID 43348270

IUPACN-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESC(CNC1=NCCS1)CN1CCOCC1
InChIInChI=1S/C10H19N3OS/c1(2-11-10-12-3-9-15-10)4-13-5-7-14-8-6-13/h1-9H2,(H,11,12)
InChIKeyPNJCYNXRFONZIC-UHFFFAOYSA-N
MW229.35 g/mol
LogP0.40
Rot. Bonds4

About N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine

N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 43348270) has the molecular formula C10H19N3OS and a molecular weight of 229.35 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID43348270
Molecular FormulaC10H19N3OS
Molecular Weight229.35 g/mol
Exact Mass229.12
IUPAC NameN-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESC(CNC1=NCCS1)CN1CCOCC1
InChIInChI=1S/C10H19N3OS/c1(2-11-10-12-3-9-15-10)4-13-5-7-14-8-6-13/h1-9H2,(H,11,12)
InChIKeyPNJCYNXRFONZIC-UHFFFAOYSA-N
XLogP0.40
TPSA36.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.35
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4,5-dihydro-1H-imidazol-2-yl 2-(4-morpholinyl)ethyl sulfide
CID 3495578
4-[2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethyl]morpholine;dihydrochloride
CID 13018881
4-[2-(4,5-dihydro-1H-imidazole-1,3-diium-2-ylsulfanyl)ethyl]morpholine
CID 4609185
4-[2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethyl]morpholin-4-ium
CID 6990433
N-(3-morpholin-4-ylpropyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 17338707
N-(2-morpholin-4-ylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 17338730
2-(2-Morpholin-4-ylethylthio)-2-imidazoline, bromide, bromide
CID 18529054
N-(2-morpholin-4-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 29068278
5-methyl-N-(2-morpholin-4-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43439981
5-methyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43440137
N-(2-ethoxyethyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 43591371
4-ethyl-N-(1-morpholin-4-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 54965081

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine (CID 43348270) is N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine is C(CNC1=NCCS1)CN1CCOCC1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is PNJCYNXRFONZIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3OS/c1(2-11-10-12-3-9-15-10)4-13-5-7-14-8-6-13/h1-9H2,(H,11,12).
What are the key properties of N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 229.35 g/mol, XLogP of 0.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 43348270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).