1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine

C11H12FN3 — CID 43314016

IUPAC1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine
SMILESCNCc1cc(F)ccc1-n1cccn1
InChIInChI=1S/C11H12FN3/c1-13-8-9-7-10(12)3-4-11(9)15-6-2-5-14-15/h2-7,13H,8H2,1H3
InChIKeyUHADYANRPLVGFQ-UHFFFAOYSA-N
MW205.24 g/mol
LogP1.73
Rot. Bonds3

About 1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine

1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine (PubChem CID 43314016) has the molecular formula C11H12FN3 and a molecular weight of 205.24 g/mol. Its IUPAC name is 1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine
PubChem CID43314016
Molecular FormulaC11H12FN3
Molecular Weight205.24 g/mol
Exact Mass205.10
IUPAC Name1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine
SMILESCNCc1cc(F)ccc1-n1cccn1
InChIInChI=1S/C11H12FN3/c1-13-8-9-7-10(12)3-4-11(9)15-6-2-5-14-15/h2-7,13H,8H2,1H3
InChIKeyUHADYANRPLVGFQ-UHFFFAOYSA-N
XLogP1.73
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(5-fluoro-2-pyrazol-1-ylphenyl)methyl]ethanamine
CID 43314015
N-[(5-fluoro-2-pyrazol-1-ylphenyl)methyl]-3-methylpentan-1-amine
CID 131922365
3-(5-fluoro-2-pyrazol-1-ylphenyl)-N,N-dimethylpropan-1-amine
CID 170865603
4-[(5-fluoro-2-pyrazol-1-ylphenyl)methyl]-2,6-dimethylmorpholine
CID 156608964
N-[(2,5-difluorophenyl)methyl]-2-pyrazol-1-ylaniline
CID 43705653
N-[(5-fluoro-2-pyrazol-1-ylphenyl)methyl]-1-(5-methyl-1-phenylpyrazol-4-yl)ethanamine
CID 45226568
1-(2-chloro-4-fluorophenyl)pyrazole
CID 91212691
1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine
CID 105390553
(3R)-N-[(5-fluoro-2-pyrazol-1-ylphenyl)methyl]-1-pyrimidin-2-ylpiperidin-3-amine
CID 42196033
1-[1-[(5-fluoro-2-pyrazol-1-ylphenyl)methyl]piperidin-4-yl]ethane-1,2-diol
CID 137341336
2-[(5-fluoro-2-pyrazol-1-ylphenyl)methyl-(2-methylpropyl)amino]acetic acid
CID 91832688
4-fluoro-2-pyrazol-1-ylbenzonitrile
CID 21069916

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine (CID 43314016) is 1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine is CNCc1cc(F)ccc1-n1cccn1.
What is the InChIKey of 1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine?
The InChIKey is UHADYANRPLVGFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3/c1-13-8-9-7-10(12)3-4-11(9)15-6-2-5-14-15/h2-7,13H,8H2,1H3.
What are the key properties of 1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine?
1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine has a molecular weight of 205.24 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-pyrazol-1-ylphenyl)-N-methylmethanamine is sourced from PubChem (CID 43314016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).