[1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine

C13H23N3OS — CID 105272985

IUPAC[1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine
SMILESCCOC(C1CC1)C(Cc1nc(C)c(C)s1)NN
InChIInChI=1S/C13H23N3OS/c1-4-17-13(10-5-6-10)11(16-14)7-12-15-8(2)9(3)18-12/h10-11,13,16H,4-7,14H2,1-3H3
InChIKeyLUEQBIVOMVOIBC-UHFFFAOYSA-N
MW269.41 g/mol
LogP1.95
Rot. Bonds7

About [1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine

[1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine (PubChem CID 105272985) has the molecular formula C13H23N3OS and a molecular weight of 269.41 g/mol. Its IUPAC name is [1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine
PubChem CID105272985
Molecular FormulaC13H23N3OS
Molecular Weight269.41 g/mol
Exact Mass269.16
IUPAC Name[1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine
SMILESCCOC(C1CC1)C(Cc1nc(C)c(C)s1)NN
InChIInChI=1S/C13H23N3OS/c1-4-17-13(10-5-6-10)11(16-14)7-12-15-8(2)9(3)18-12/h10-11,13,16H,4-7,14H2,1-3H3
InChIKeyLUEQBIVOMVOIBC-UHFFFAOYSA-N
XLogP1.95
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.41
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine?
The IUPAC name of [1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine (CID 105272985) is [1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine.
What is the SMILES notation for [1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine?
The canonical SMILES for [1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine is CCOC(C1CC1)C(Cc1nc(C)c(C)s1)NN.
What is the InChIKey of [1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine?
The InChIKey is LUEQBIVOMVOIBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3OS/c1-4-17-13(10-5-6-10)11(16-14)7-12-15-8(2)9(3)18-12/h10-11,13,16H,4-7,14H2,1-3H3.
What are the key properties of [1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine?
[1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine has a molecular weight of 269.41 g/mol, XLogP of 1.95, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclopropyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethoxypropan-2-yl]hydrazine is sourced from PubChem (CID 105272985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).