1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine

C11H12FN3 — CID 43662344

IUPAC1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine
SMILESFc1ccccc1CNCc1ccn[nH]1
InChIInChI=1S/C11H12FN3/c12-11-4-2-1-3-9(11)7-13-8-10-5-6-14-15-10/h1-6,13H,7-8H2,(H,14,15)
InChIKeyKFFOJIDCLRFSRB-UHFFFAOYSA-N
MW205.24 g/mol
LogP1.84
Rot. Bonds4

About 1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine

1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine (PubChem CID 43662344) has the molecular formula C11H12FN3 and a molecular weight of 205.24 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine
PubChem CID43662344
Molecular FormulaC11H12FN3
Molecular Weight205.24 g/mol
Exact Mass205.10
IUPAC Name1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine
SMILESFc1ccccc1CNCc1ccn[nH]1
InChIInChI=1S/C11H12FN3/c12-11-4-2-1-3-9(11)7-13-8-10-5-6-14-15-10/h1-6,13H,7-8H2,(H,14,15)
InChIKeyKFFOJIDCLRFSRB-UHFFFAOYSA-N
XLogP1.84
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bromophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine
CID 61286252
1-[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]-N-(1H-pyrazol-5-ylmethyl)methanamine
CID 119110021
1-(2-fluorophenyl)-N-(pyridin-2-ylmethyl)methanamine
CID 1085208
2-(2,6-difluorophenyl)-N-(1H-pyrazol-5-ylmethyl)acetamide
CID 71683363
N-[(2-fluorophenyl)methyl]-1-(2-pyrazol-1-ylphenyl)methanamine
CID 61167301
N-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methyl]-1-(1H-pyrazol-5-yl)methanamine
CID 61284885
[(2-fluorophenyl)methylamino]methanethiol
CID 115227992
3-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)cyclobutan-1-amine
CID 61285083
1-(1H-pyrazol-5-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)methanamine
CID 60979310
1-(2-fluorophenyl)-N-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]methanamine
CID 43233210
1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 61286025
N-[(2-fluorophenyl)methyl]-1-(2-nitrophenyl)methanamine
CID 28582574

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine?
The IUPAC name of 1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine (CID 43662344) is 1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine?
The canonical SMILES for 1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine is Fc1ccccc1CNCc1ccn[nH]1.
What is the InChIKey of 1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine?
The InChIKey is KFFOJIDCLRFSRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3/c12-11-4-2-1-3-9(11)7-13-8-10-5-6-14-15-10/h1-6,13H,7-8H2,(H,14,15).
What are the key properties of 1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine?
1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine has a molecular weight of 205.24 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine is sourced from PubChem (CID 43662344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).