5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine

C11H13ClN6 — CID 105260556

IUPAC5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine
SMILESCc1nccc(C(NN)c2cc(Cl)cnc2N)n1
InChIInChI=1S/C11H13ClN6/c1-6-15-3-2-9(17-6)10(18-14)8-4-7(12)5-16-11(8)13/h2-5,10,18H,14H2,1H3,(H2,13,16)
InChIKeyACXRGRAHQNGLGS-UHFFFAOYSA-N
MW264.72 g/mol
LogP0.97
Rot. Bonds3

About 5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine

5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine (PubChem CID 105260556) has the molecular formula C11H13ClN6 and a molecular weight of 264.72 g/mol. Its IUPAC name is 5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine
PubChem CID105260556
Molecular FormulaC11H13ClN6
Molecular Weight264.72 g/mol
Exact Mass264.09
IUPAC Name5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine
SMILESCc1nccc(C(NN)c2cc(Cl)cnc2N)n1
InChIInChI=1S/C11H13ClN6/c1-6-15-3-2-9(17-6)10(18-14)8-4-7(12)5-16-11(8)13/h2-5,10,18H,14H2,1H3,(H2,13,16)
InChIKeyACXRGRAHQNGLGS-UHFFFAOYSA-N
XLogP0.97
TPSA102.74 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.72
LogP ≤ 50.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[(3,4-dichlorophenyl)-(2-methylpyrimidin-4-yl)methyl]hydrazine
CID 105260527
5-chloro-3-[hydrazinyl(phenyl)methyl]pyridin-2-amine
CID 105199320
[(5-bromo-2-fluorophenyl)-(2-methylpyrimidin-4-yl)methyl]hydrazine
CID 105260559
[(5-methyl-3-pyridinyl)-(2-methylpyrimidin-4-yl)methyl]hydrazine
CID 105260453
3-[(5-amino-1-methylpyrazol-4-yl)-hydrazinylmethyl]-5-chloropyridin-2-amine
CID 105230884
5-chloro-3-[hydrazinyl(1H-imidazol-2-yl)methyl]pyridin-2-amine
CID 105252211
5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine
CID 105258421
5-chloro-3-[(3-ethyl-2-pyridinyl)-hydrazinylmethyl]pyridin-2-amine
CID 105263852
5-chloro-3-[(2-chloro-4-fluorophenyl)-hydrazinylmethyl]pyridin-2-amine
CID 105215434
3-[(5-amino-1H-pyrazol-4-yl)-hydrazinylmethyl]-5-chloropyridin-2-amine
CID 105231228
[(2-methylpyrimidin-4-yl)-(3-phenyltriazol-4-yl)methyl]hydrazine
CID 105260678
[(1-methylpyrazol-4-yl)-(2-methylpyrimidin-4-yl)methyl]hydrazine
CID 105260408

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine?
The IUPAC name of 5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine (CID 105260556) is 5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine is Cc1nccc(C(NN)c2cc(Cl)cnc2N)n1.
What is the InChIKey of 5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine?
The InChIKey is ACXRGRAHQNGLGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN6/c1-6-15-3-2-9(17-6)10(18-14)8-4-7(12)5-16-11(8)13/h2-5,10,18H,14H2,1H3,(H2,13,16).
What are the key properties of 5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine?
5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine has a molecular weight of 264.72 g/mol, XLogP of 0.97, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 105260556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).