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

C12H21N5OS — CID 79765681

IUPAC[5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(CN2CCC(N3CCOCC3)C2)s1
InChIInChI=1S/C12H21N5OS/c13-15-12-14-7-11(19-12)9-16-2-1-10(8-16)17-3-5-18-6-4-17/h7,10H,1-6,8-9,13H2,(H,14,15)
InChIKeyVNUPDSVWPPPHDC-UHFFFAOYSA-N
MW283.40 g/mol
LogP0.34
Rot. Bonds4

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

[5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine (PubChem CID 79765681) has the molecular formula C12H21N5OS and a molecular weight of 283.40 g/mol. Its IUPAC name is [5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine
PubChem CID79765681
Molecular FormulaC12H21N5OS
Molecular Weight283.40 g/mol
Exact Mass283.15
IUPAC Name[5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(CN2CCC(N3CCOCC3)C2)s1
InChIInChI=1S/C12H21N5OS/c13-15-12-14-7-11(19-12)9-16-2-1-10(8-16)17-3-5-18-6-4-17/h7,10H,1-6,8-9,13H2,(H,14,15)
InChIKeyVNUPDSVWPPPHDC-UHFFFAOYSA-N
XLogP0.34
TPSA66.65 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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 [5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine (CID 79765681) is [5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine is NNc1ncc(CN2CCC(N3CCOCC3)C2)s1.
What is the InChIKey of [5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine?
The InChIKey is VNUPDSVWPPPHDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5OS/c13-15-12-14-7-11(19-12)9-16-2-1-10(8-16)17-3-5-18-6-4-17/h7,10H,1-6,8-9,13H2,(H,14,15).
What are the key properties of [5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine?
[5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine has a molecular weight of 283.40 g/mol, XLogP of 0.34, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79765681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).