[4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine

C10H13N7S — CID 62464170

IUPAC[4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine
SMILESNNc1cc(CSc2nnnn2C2CC2)ccn1
InChIInChI=1S/C10H13N7S/c11-13-9-5-7(3-4-12-9)6-18-10-14-15-16-17(10)8-1-2-8/h3-5,8H,1-2,6,11H2,(H,12,13)
InChIKeySDOXYZJOVPYNKC-UHFFFAOYSA-N
MW263.33 g/mol
LogP0.98
Rot. Bonds5

About [4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine

[4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine (PubChem CID 62464170) has the molecular formula C10H13N7S and a molecular weight of 263.33 g/mol. Its IUPAC name is [4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine
PubChem CID62464170
Molecular FormulaC10H13N7S
Molecular Weight263.33 g/mol
Exact Mass263.10
IUPAC Name[4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine
SMILESNNc1cc(CSc2nnnn2C2CC2)ccn1
InChIInChI=1S/C10H13N7S/c11-13-9-5-7(3-4-12-9)6-18-10-14-15-16-17(10)8-1-2-8/h3-5,8H,1-2,6,11H2,(H,12,13)
InChIKeySDOXYZJOVPYNKC-UHFFFAOYSA-N
XLogP0.98
TPSA94.54 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.33
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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 [4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine?
The IUPAC name of [4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine (CID 62464170) is [4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine is NNc1cc(CSc2nnnn2C2CC2)ccn1.
What is the InChIKey of [4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine?
The InChIKey is SDOXYZJOVPYNKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N7S/c11-13-9-5-7(3-4-12-9)6-18-10-14-15-16-17(10)8-1-2-8/h3-5,8H,1-2,6,11H2,(H,12,13).
What are the key properties of [4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine?
[4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine has a molecular weight of 263.33 g/mol, XLogP of 0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 62464170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).