5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine

C14H17ClN4O — CID 105258421

IUPAC5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine
SMILESCOc1ccc(C(NN)c2cc(Cl)cnc2N)cc1C
InChIInChI=1S/C14H17ClN4O/c1-8-5-9(3-4-12(8)20-2)13(19-17)11-6-10(15)7-18-14(11)16/h3-7,13,19H,17H2,1-2H3,(H2,16,18)
InChIKeyYFNOAXAHJNGYFZ-UHFFFAOYSA-N
MW292.77 g/mol
LogP2.19
Rot. Bonds4

About 5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine

5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine (PubChem CID 105258421) has the molecular formula C14H17ClN4O and a molecular weight of 292.77 g/mol. Its IUPAC name is 5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine
PubChem CID105258421
Molecular FormulaC14H17ClN4O
Molecular Weight292.77 g/mol
Exact Mass292.11
IUPAC Name5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine
SMILESCOc1ccc(C(NN)c2cc(Cl)cnc2N)cc1C
InChIInChI=1S/C14H17ClN4O/c1-8-5-9(3-4-12(8)20-2)13(19-17)11-6-10(15)7-18-14(11)16/h3-7,13,19H,17H2,1-2H3,(H2,16,18)
InChIKeyYFNOAXAHJNGYFZ-UHFFFAOYSA-N
XLogP2.19
TPSA86.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.77
LogP ≤ 52.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(4-chlorophenyl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 105258369
5-chloro-3-[hydrazinyl(phenyl)methyl]pyridin-2-amine
CID 105199320
[(5-chloro-2-methoxyphenyl)-(4-chloro-3-methylphenyl)methyl]hydrazine
CID 105300853
[(4-chloro-3-methoxyphenyl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 105258314
5-chloro-3-[ethylamino-(4-fluoro-3-methoxyphenyl)methyl]pyridin-2-amine
CID 107922698
[(3-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 107362142
5-chloro-3-[(3,4-dichlorophenyl)-(methylamino)methyl]pyridin-2-amine
CID 81492008
[(4-chloro-3-methylphenyl)-(2-methoxy-5-methylphenyl)methyl]hydrazine
CID 105303497
3-[(3-chlorophenyl)-hydrazinylmethyl]-5-methylpyridin-2-amine
CID 105194796
[(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 105258417
5-chloro-3-[hydrazinyl-(2-methylpyrimidin-4-yl)methyl]pyridin-2-amine
CID 105260556
[(4-methoxy-3-methylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
CID 105258318

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine?
The IUPAC name of 5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine (CID 105258421) is 5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine is COc1ccc(C(NN)c2cc(Cl)cnc2N)cc1C.
What is the InChIKey of 5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine?
The InChIKey is YFNOAXAHJNGYFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN4O/c1-8-5-9(3-4-12(8)20-2)13(19-17)11-6-10(15)7-18-14(11)16/h3-7,13,19H,17H2,1-2H3,(H2,16,18).
What are the key properties of 5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine?
5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine has a molecular weight of 292.77 g/mol, XLogP of 2.19, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine is sourced from PubChem (CID 105258421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).