3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine

C12H13Cl2N5 — CID 102761658

IUPAC3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine
SMILESCN(Cc1cccnc1)c1nc(NN)c(Cl)cc1Cl
InChIInChI=1S/C12H13Cl2N5/c1-19(7-8-3-2-4-16-6-8)12-10(14)5-9(13)11(17-12)18-15/h2-6H,7,15H2,1H3,(H,17,18)
InChIKeyMHJFVAZNTSOVCA-UHFFFAOYSA-N
MW298.18 g/mol
LogP2.71
Rot. Bonds4

About 3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine

3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine (PubChem CID 102761658) has the molecular formula C12H13Cl2N5 and a molecular weight of 298.18 g/mol. Its IUPAC name is 3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine
PubChem CID102761658
Molecular FormulaC12H13Cl2N5
Molecular Weight298.18 g/mol
Exact Mass297.05
IUPAC Name3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine
SMILESCN(Cc1cccnc1)c1nc(NN)c(Cl)cc1Cl
InChIInChI=1S/C12H13Cl2N5/c1-19(7-8-3-2-4-16-6-8)12-10(14)5-9(13)11(17-12)18-15/h2-6H,7,15H2,1H3,(H,17,18)
InChIKeyMHJFVAZNTSOVCA-UHFFFAOYSA-N
XLogP2.71
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.18
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

3,5,6-trichloro-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine
CID 102750389
3,5-dichloro-6-hydrazinyl-N-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine
CID 102762378
3,5-dichloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridin-2-amine
CID 102761719
5-ethyl-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 80906617
3-chloro-N-methyl-5-[(propan-2-ylamino)methyl]-N-(pyridin-3-ylmethyl)pyridin-2-amine
CID 62281535
3,5-dichloro-6-hydrazinyl-N-methyl-N-(2-methylpropyl)pyridin-2-amine
CID 102761612
6-hydrazinyl-N-methyl-5-propyl-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 80906104
3,5-dichloro-6-hydrazinyl-N,N-dimethylpyridin-2-amine
CID 102762384
2-N,5-dimethyl-2-N-(pyridin-3-ylmethyl)pyridine-2,3-diamine
CID 66278201
2-hydrazinyl-N,6-dimethyl-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 80906105
2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)-methylamino]acetamide
CID 102761628
2-(aminomethyl)-3-chloro-N-methyl-N-(pyridin-3-ylmethyl)aniline
CID 43563639

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine (CID 102761658) is 3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine is CN(Cc1cccnc1)c1nc(NN)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine?
The InChIKey is MHJFVAZNTSOVCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13Cl2N5/c1-19(7-8-3-2-4-16-6-8)12-10(14)5-9(13)11(17-12)18-15/h2-6H,7,15H2,1H3,(H,17,18).
What are the key properties of 3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine?
3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine has a molecular weight of 298.18 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-hydrazinyl-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 102761658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).