5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine

C12H15ClN6 — CID 80932166

IUPAC5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
SMILESCN(CCc1ccccn1)c1nc(NN)ncc1Cl
InChIInChI=1S/C12H15ClN6/c1-19(7-5-9-4-2-3-6-15-9)11-10(13)8-16-12(17-11)18-14/h2-4,6,8H,5,7,14H2,1H3,(H,16,17,18)
InChIKeySYZOHLITPOBCOW-UHFFFAOYSA-N
MW278.75 g/mol
LogP1.49
Rot. Bonds5

About 5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine

5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine (PubChem CID 80932166) has the molecular formula C12H15ClN6 and a molecular weight of 278.75 g/mol. Its IUPAC name is 5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
PubChem CID80932166
Molecular FormulaC12H15ClN6
Molecular Weight278.75 g/mol
Exact Mass278.10
IUPAC Name5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
SMILESCN(CCc1ccccn1)c1nc(NN)ncc1Cl
InChIInChI=1S/C12H15ClN6/c1-19(7-5-9-4-2-3-6-15-9)11-10(13)8-16-12(17-11)18-14/h2-4,6,8H,5,7,14H2,1H3,(H,16,17,18)
InChIKeySYZOHLITPOBCOW-UHFFFAOYSA-N
XLogP1.49
TPSA79.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.75
LogP ≤ 51.49
H-Bond Donors ≤ 52
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

5-chloro-4-N-methyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine
CID 80766045
5-chloro-2-hydrazinyl-N-(3-methoxypropyl)-N-methylpyrimidin-4-amine
CID 80913814
4-N,5-dimethyl-2-N-propyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine
CID 80750116
5-fluoro-2-hydrazinyl-N-methyl-N-(2-phenylethyl)pyrimidin-4-amine
CID 80931324
6-hydrazinyl-N-methyl-5-propan-2-yl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 80911233
4-N-methyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine
CID 80765765
5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine
CID 62279474
4-N,6-N,2,5-tetramethyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
CID 80766493
[5-[methyl(2-pyridin-2-ylethyl)amino]pyrazin-2-yl]methanol
CID 107372677
6-hydrazinyl-N-methyl-2-propyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 80944141
2-chloro-N'-hydroxy-6-[methyl(2-pyridin-2-ylethyl)amino]benzenecarboximidamide
CID 76945369
2-chloro-6-[methyl(2-pyridin-2-ylethyl)amino]benzenecarboximidamide
CID 62502784

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine?
The IUPAC name of 5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine (CID 80932166) is 5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine.
What is the SMILES notation for 5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine?
The canonical SMILES for 5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine is CN(CCc1ccccn1)c1nc(NN)ncc1Cl.
What is the InChIKey of 5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine?
The InChIKey is SYZOHLITPOBCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN6/c1-19(7-5-9-4-2-3-6-15-9)11-10(13)8-16-12(17-11)18-14/h2-4,6,8H,5,7,14H2,1H3,(H,16,17,18).
What are the key properties of 5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine?
5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine has a molecular weight of 278.75 g/mol, XLogP of 1.49, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydrazinyl-N-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine is sourced from PubChem (CID 80932166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).