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

C13H23N3OS — CID 63296516

IUPAC5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESC(CNC1=NCC(C2CC2)S1)CN1CCOCC1
InChIInChI=1S/C13H23N3OS/c1(5-16-6-8-17-9-7-16)4-14-13-15-10-12(18-13)11-2-3-11/h11-12H,1-10H2,(H,14,15)
InChIKeyRSKHVWOETKPDFZ-UHFFFAOYSA-N
MW269.41 g/mol
LogP1.18
Rot. Bonds5

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

5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 63296516) has the molecular formula C13H23N3OS and a molecular weight of 269.41 g/mol. Its IUPAC name is 5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID63296516
Molecular FormulaC13H23N3OS
Molecular Weight269.41 g/mol
Exact Mass269.16
IUPAC Name5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESC(CNC1=NCC(C2CC2)S1)CN1CCOCC1
InChIInChI=1S/C13H23N3OS/c1(5-16-6-8-17-9-7-16)4-14-13-15-10-12(18-13)11-2-3-11/h11-12H,1-10H2,(H,14,15)
InChIKeyRSKHVWOETKPDFZ-UHFFFAOYSA-N
XLogP1.18
TPSA36.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.41
LogP ≤ 51.18
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

N-(3-morpholin-4-ylpropyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 17338707
N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43348270
5-methyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 43440137
4-(2-methylpropyl)-N-(1-morpholin-4-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61504464
5-cyclopropyl-N-(1-morpholin-4-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63296169
5-cyclopropyl-N-(2-ethoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63296247
5-cyclopropyl-N-(2-morpholin-4-ylethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63296425
5-cyclopropyl-N-(oxan-2-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63296435
5-cyclopropyl-N-(1,4-dioxan-2-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63296479
5-cyclopropyl-N-(1-ethoxypropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63296485
5-cyclopropyl-N-[2-(3-methylbutoxy)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 63296576
N-(2-butoxyethyl)-5-cyclopropyl-4,5-dihydro-1,3-thiazol-2-amine
CID 63296577

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine (CID 63296516) is 5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine is C(CNC1=NCC(C2CC2)S1)CN1CCOCC1.
What is the InChIKey of 5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is RSKHVWOETKPDFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3OS/c1(5-16-6-8-17-9-7-16)4-14-13-15-10-12(18-13)11-2-3-11/h11-12H,1-10H2,(H,14,15).
What are the key properties of 5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 269.41 g/mol, XLogP of 1.18, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(3-morpholin-4-ylpropyl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 63296516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).