[4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine

C15H11F3N4 — CID 91926262

IUPAC[4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
SMILESNNc1nc(-c2ccc3ccccc3c2)cc(C(F)(F)F)n1
InChIInChI=1S/C15H11F3N4/c16-15(17,18)13-8-12(20-14(21-13)22-19)11-6-5-9-3-1-2-4-10(9)7-11/h1-8H,19H2,(H,20,21,22)
InChIKeyDKGCHLRRCHOXGP-UHFFFAOYSA-N
MW304.28 g/mol
LogP3.60
Rot. Bonds2

About [4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine

[4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine (PubChem CID 91926262) has the molecular formula C15H11F3N4 and a molecular weight of 304.28 g/mol. Its IUPAC name is [4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
PubChem CID91926262
Molecular FormulaC15H11F3N4
Molecular Weight304.28 g/mol
Exact Mass304.09
IUPAC Name[4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
SMILESNNc1nc(-c2ccc3ccccc3c2)cc(C(F)(F)F)n1
InChIInChI=1S/C15H11F3N4/c16-15(17,18)13-8-12(20-14(21-13)22-19)11-6-5-9-3-1-2-4-10(9)7-11/h1-8H,19H2,(H,20,21,22)
InChIKeyDKGCHLRRCHOXGP-UHFFFAOYSA-N
XLogP3.60
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.28
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-chloro-4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidine
CID 112693753
[4-(2-methylphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
CID 91926616
2-methylsulfonyl-4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidine
CID 16654692
2-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]amino]guanidine
CID 12519366
N-methyl-4-(4-propan-2-ylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 114563283
[4-(2-ethylpyrazol-3-yl)-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
CID 19620940
4-quinolin-7-yl-6-(trifluoromethyl)pyrimidin-2-amine
CID 114563437
N,4-bis(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 1419469
[4-(4-methoxyphenyl)-6-phenylpyrimidin-2-yl]hydrazine
CID 23649159
[[4-(4-methylphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]amino]thiourea
CID 91927366
[4-(3-methoxyphenoxy)-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
CID 114567735
[4-(3-chlorophenoxy)-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
CID 114567750

Frequently Asked Questions

What is the IUPAC name of [4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine?
The IUPAC name of [4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine (CID 91926262) is [4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine is NNc1nc(-c2ccc3ccccc3c2)cc(C(F)(F)F)n1.
What is the InChIKey of [4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine?
The InChIKey is DKGCHLRRCHOXGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3N4/c16-15(17,18)13-8-12(20-14(21-13)22-19)11-6-5-9-3-1-2-4-10(9)7-11/h1-8H,19H2,(H,20,21,22).
What are the key properties of [4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine?
[4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine has a molecular weight of 304.28 g/mol, XLogP of 3.60, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-naphthalen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 91926262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).