[1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine

C10H14ClN5 — CID 89371026

IUPAC[1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine
SMILESCN1CCN(Cc2ccc(Cl)nc2)C1=NN
InChIInChI=1S/C10H14ClN5/c1-15-4-5-16(10(15)14-12)7-8-2-3-9(11)13-6-8/h2-3,6H,4-5,7,12H2,1H3
InChIKeyGFBNNZJQGQNEHU-UHFFFAOYSA-N
MW239.71 g/mol
LogP0.71
Rot. Bonds2

About [1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine

[1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine (PubChem CID 89371026) has the molecular formula C10H14ClN5 and a molecular weight of 239.71 g/mol. Its IUPAC name is [1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine.

Molecular Properties

Compound Name[1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine
PubChem CID89371026
Molecular FormulaC10H14ClN5
Molecular Weight239.71 g/mol
Exact Mass239.09
IUPAC Name[1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine
SMILESCN1CCN(Cc2ccc(Cl)nc2)C1=NN
InChIInChI=1S/C10H14ClN5/c1-15-4-5-16(10(15)14-12)7-8-2-3-9(11)13-6-8/h2-3,6H,4-5,7,12H2,1H3
InChIKeyGFBNNZJQGQNEHU-UHFFFAOYSA-N
XLogP0.71
TPSA57.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.71
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', '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-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine?
The IUPAC name of [1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine (CID 89371026) is [1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine.
What is the SMILES notation for [1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine?
The canonical SMILES for [1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine is CN1CCN(Cc2ccc(Cl)nc2)C1=NN.
What is the InChIKey of [1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine?
The InChIKey is GFBNNZJQGQNEHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN5/c1-15-4-5-16(10(15)14-12)7-8-2-3-9(11)13-6-8/h2-3,6H,4-5,7,12H2,1H3.
What are the key properties of [1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine?
[1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine has a molecular weight of 239.71 g/mol, XLogP of 0.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(6-chloro-3-pyridinyl)methyl]-3-methylimidazolidin-2-ylidene]hydrazine is sourced from PubChem (CID 89371026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).