1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine

C14H14F3N3 — CID 123357210

IUPAC1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1ccc(NNCc2cccc(C(F)(F)F)c2)nc1
InChIInChI=1S/C14H14F3N3/c1-10-5-6-13(18-8-10)20-19-9-11-3-2-4-12(7-11)14(15,16)17/h2-8,19H,9H2,1H3,(H,18,20)
InChIKeyNQEHXRBIHPGPAW-UHFFFAOYSA-N
MW281.28 g/mol
LogP3.53
Rot. Bonds4

About 1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine

1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 123357210) has the molecular formula C14H14F3N3 and a molecular weight of 281.28 g/mol. Its IUPAC name is 1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID123357210
Molecular FormulaC14H14F3N3
Molecular Weight281.28 g/mol
Exact Mass281.11
IUPAC Name1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1ccc(NNCc2cccc(C(F)(F)F)c2)nc1
InChIInChI=1S/C14H14F3N3/c1-10-5-6-13(18-8-10)20-19-9-11-3-2-4-12(7-11)14(15,16)17/h2-8,19H,9H2,1H3,(H,18,20)
InChIKeyNQEHXRBIHPGPAW-UHFFFAOYSA-N
XLogP3.53
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(5-methyl-2-pyridinyl)-3-[3-(trifluoromethyl)phenyl]thiourea
CID 19686091
1-(4-methylphenyl)-3-[[3-(trifluoromethyl)phenyl]methyl]urea
CID 4531191
1-methyl-4-[[3-(trifluoromethyl)phenyl]methyl]benzene
CID 122368794
N-methyl-1-[3-(trifluoromethyl)phenyl]methanamine;molecular hydrogen
CID 145483676
5-bromo-N-[[3-(trifluoromethyl)phenyl]methyl]pyrimidin-2-amine
CID 63871875
2-chloro-5-methyl-4-[[3-(trifluoromethyl)phenyl]methyl]pyrimidine
CID 12056714
N-[(4-methylphenyl)methyl]-5-(trifluoromethyl)pyridin-2-amine
CID 29047903
2-methoxy-5-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]aniline
CID 791955
N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1-[3-(trifluoromethyl)phenyl]methanamine
CID 55173216
N-[(6-methyl-2-pyridinyl)methyl]-1-[3-(trifluoromethyl)phenyl]methanamine
CID 60962305
7-(5-methyl-2-pyridinyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-6,8-dihydro-5H-2,7-naphthyridin-1-amine
CID 162564278
2-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyridin-3-amine
CID 65485316

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of 1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine (CID 123357210) is 1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for 1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for 1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine is Cc1ccc(NNCc2cccc(C(F)(F)F)c2)nc1.
What is the InChIKey of 1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is NQEHXRBIHPGPAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N3/c1-10-5-6-13(18-8-10)20-19-9-11-3-2-4-12(7-11)14(15,16)17/h2-8,19H,9H2,1H3,(H,18,20).
What are the key properties of 1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine?
1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 281.28 g/mol, XLogP of 3.53, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-2-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 123357210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).