3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine

C11H12ClN5 — CID 105252731

IUPAC3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine
SMILESNNC(c1ccnc(Cl)c1)c1cccnc1N
InChIInChI=1S/C11H12ClN5/c12-9-6-7(3-5-15-9)10(17-14)8-2-1-4-16-11(8)13/h1-6,10,17H,14H2,(H2,13,16)
InChIKeyLCDXVBSRXZSCOQ-UHFFFAOYSA-N
MW249.71 g/mol
LogP1.26
Rot. Bonds3

About 3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine

3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine (PubChem CID 105252731) has the molecular formula C11H12ClN5 and a molecular weight of 249.71 g/mol. Its IUPAC name is 3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine
PubChem CID105252731
Molecular FormulaC11H12ClN5
Molecular Weight249.71 g/mol
Exact Mass249.08
IUPAC Name3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine
SMILESNNC(c1ccnc(Cl)c1)c1cccnc1N
InChIInChI=1S/C11H12ClN5/c12-9-6-7(3-5-15-9)10(17-14)8-2-1-4-16-11(8)13/h1-6,10,17H,14H2,(H2,13,16)
InChIKeyLCDXVBSRXZSCOQ-UHFFFAOYSA-N
XLogP1.26
TPSA89.85 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.71
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[(3,5-dichlorophenyl)-hydrazinylmethyl]pyridin-2-amine
CID 107918402
3-[furan-3-yl(hydrazinyl)methyl]pyridin-2-amine
CID 105221322
3-[(5-bromo-3-pyridinyl)-hydrazinylmethyl]pyridin-2-amine
CID 105251142
3-[(4-ethylphenyl)-hydrazinylmethyl]pyridin-2-amine
CID 105197382
3-[hydrazinyl-(4-methoxyphenyl)methyl]pyridin-2-amine
CID 105190854
[(2-chloro-4-pyridinyl)-(5-fluoro-2-methylphenyl)methyl]hydrazine
CID 105252636
3-[hydrazinyl(naphthalen-1-yl)methyl]pyridin-2-amine
CID 105213234
3-[(3-bromo-2-pyridinyl)-hydrazinylmethyl]pyridin-2-amine
CID 105268078
[(2-chloro-4-pyridinyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
CID 105252908
[(2-chloro-4-pyridinyl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105252881
[(3-bromothiophen-2-yl)-(2-chloro-4-pyridinyl)methyl]hydrazine
CID 105252869
3-(1-hydrazinyl-2-methoxypropyl)pyridin-2-amine
CID 105246942

Frequently Asked Questions

What is the IUPAC name of 3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine?
The IUPAC name of 3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine (CID 105252731) is 3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine.
What is the SMILES notation for 3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine?
The canonical SMILES for 3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine is NNC(c1ccnc(Cl)c1)c1cccnc1N.
What is the InChIKey of 3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine?
The InChIKey is LCDXVBSRXZSCOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN5/c12-9-6-7(3-5-15-9)10(17-14)8-2-1-4-16-11(8)13/h1-6,10,17H,14H2,(H2,13,16).
What are the key properties of 3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine?
3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine has a molecular weight of 249.71 g/mol, XLogP of 1.26, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-chloro-4-pyridinyl)-hydrazinylmethyl]pyridin-2-amine is sourced from PubChem (CID 105252731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).