2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine

C16H21N5 — CID 80968890

IUPAC2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine
SMILESCC(C)c1ccccc1Nc1cc(NN)nc(C2CC2)n1
InChIInChI=1S/C16H21N5/c1-10(2)12-5-3-4-6-13(12)18-14-9-15(21-17)20-16(19-14)11-7-8-11/h3-6,9-11H,7-8,17H2,1-2H3,(H2,18,19,20,21)
InChIKeyMNDZLIJDFLALPW-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.51
Rot. Bonds5

About 2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine

2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine (PubChem CID 80968890) has the molecular formula C16H21N5 and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine
PubChem CID80968890
Molecular FormulaC16H21N5
Molecular Weight283.38 g/mol
Exact Mass283.18
IUPAC Name2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine
SMILESCC(C)c1ccccc1Nc1cc(NN)nc(C2CC2)n1
InChIInChI=1S/C16H21N5/c1-10(2)12-5-3-4-6-13(12)18-14-9-15(21-17)20-16(19-14)11-7-8-11/h3-6,9-11H,7-8,17H2,1-2H3,(H2,18,19,20,21)
InChIKeyMNDZLIJDFLALPW-UHFFFAOYSA-N
XLogP3.51
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.51
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'}

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Related Compounds

2-cyclopropyl-N-(2-ethoxyphenyl)-6-hydrazinylpyrimidin-4-amine
CID 80969313
2-cyclopropyl-N-(2,3-dimethylphenyl)-6-hydrazinylpyrimidin-4-amine
CID 80969126
2-cyclopropyl-N-(2,5-dimethylphenyl)-6-hydrazinylpyrimidin-4-amine
CID 80968268
2-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine
CID 80920603
N-(2-chloro-4-methylphenyl)-2-cyclopropyl-6-hydrazinylpyrimidin-4-amine
CID 80969702
N-(5-chloro-2-fluorophenyl)-2-cyclopropyl-6-hydrazinylpyrimidin-4-amine
CID 80964867
2-cyclopropyl-N-(2,5-difluorophenyl)-6-hydrazinylpyrimidin-4-amine
CID 80969096
2-cyclopropyl-N-(2,6-dichlorophenyl)-6-hydrazinylpyrimidin-4-amine
CID 80969290
2-cyclopropyl-6-hydrazinyl-N-(4-methoxy-2-methylphenyl)pyrimidin-4-amine
CID 80964846
6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine
CID 107647320
2-cyclopropyl-N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinylpyrimidin-4-amine
CID 107465277
[6-propan-2-yl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]hydrazine
CID 65400565

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine (CID 80968890) is 2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine is CC(C)c1ccccc1Nc1cc(NN)nc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine?
The InChIKey is MNDZLIJDFLALPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5/c1-10(2)12-5-3-4-6-13(12)18-14-9-15(21-17)20-16(19-14)11-7-8-11/h3-6,9-11H,7-8,17H2,1-2H3,(H2,18,19,20,21).
What are the key properties of 2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine?
2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine has a molecular weight of 283.38 g/mol, XLogP of 3.51, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine is sourced from PubChem (CID 80968890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).