2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine

C15H18FN5 — CID 81007580

IUPAC2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine
SMILESCc1c(NN)nc(C2CC2)nc1N(C)c1cccc(F)c1
InChIInChI=1S/C15H18FN5/c1-9-13(20-17)18-14(10-6-7-10)19-15(9)21(2)12-5-3-4-11(16)8-12/h3-5,8,10H,6-7,17H2,1-2H3,(H,18,19,20)
InChIKeyBSYDXTJFWPWUOW-UHFFFAOYSA-N
MW287.34 g/mol
LogP2.86
Rot. Bonds4

About 2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine

2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine (PubChem CID 81007580) has the molecular formula C15H18FN5 and a molecular weight of 287.34 g/mol. Its IUPAC name is 2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine
PubChem CID81007580
Molecular FormulaC15H18FN5
Molecular Weight287.34 g/mol
Exact Mass287.15
IUPAC Name2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine
SMILESCc1c(NN)nc(C2CC2)nc1N(C)c1cccc(F)c1
InChIInChI=1S/C15H18FN5/c1-9-13(20-17)18-14(10-6-7-10)19-15(9)21(2)12-5-3-4-11(16)8-12/h3-5,8,10H,6-7,17H2,1-2H3,(H,18,19,20)
InChIKeyBSYDXTJFWPWUOW-UHFFFAOYSA-N
XLogP2.86
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 52.86
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

2-cyclopropyl-4-N,5-dimethyl-4-N-(3-methylphenyl)pyrimidine-4,6-diamine
CID 80982951
2-cyclopropyl-4-N-(3-fluorophenyl)-4-N-methylpyrimidine-4,6-diamine
CID 80957673
2-cyclopropyl-4-N-(3-fluorophenyl)-5-methylpyrimidine-4,6-diamine
CID 80977204
2-cyclopropyl-6-hydrazinyl-N,5-dimethyl-N-propan-2-ylpyrimidin-4-amine
CID 81000896
2-cyclopropyl-6-hydrazinyl-5-methyl-N-(3-methylphenyl)pyrimidin-4-amine
CID 81007517
6-chloro-2-cyclopropyl-N-(3-methoxyphenyl)-N,5-dimethylpyrimidin-4-amine
CID 80972239
2-cyclopropyl-6-hydrazinyl-N,5-dimethyl-N-(thiolan-3-yl)pyrimidin-4-amine
CID 80995592
6-chloro-2-cyclopropyl-N-[(3-fluorophenyl)methyl]-5-methylpyrimidin-4-amine
CID 80970425
N-(4-bromo-3-fluorophenyl)-2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 81006460
2-[(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
CID 80995526
2-cyclopropyl-6-hydrazinyl-N,5-dimethyl-N-pentan-2-ylpyrimidin-4-amine
CID 80995701
2-cyclopropyl-6-(3-fluorophenoxy)-5-methylpyrimidin-4-amine
CID 80988620

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine (CID 81007580) is 2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine is Cc1c(NN)nc(C2CC2)nc1N(C)c1cccc(F)c1.
What is the InChIKey of 2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine?
The InChIKey is BSYDXTJFWPWUOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN5/c1-9-13(20-17)18-14(10-6-7-10)19-15(9)21(2)12-5-3-4-11(16)8-12/h3-5,8,10H,6-7,17H2,1-2H3,(H,18,19,20).
What are the key properties of 2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine?
2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine has a molecular weight of 287.34 g/mol, XLogP of 2.86, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(3-fluorophenyl)-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 81007580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).