1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine

C10H9F2N3 — CID 60783235

IUPAC1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine
SMILESNc1ccn(Cc2cccc(F)c2F)n1
InChIInChI=1S/C10H9F2N3/c11-8-3-1-2-7(10(8)12)6-15-5-4-9(13)14-15/h1-5H,6H2,(H2,13,14)
InChIKeyDDBZXFPNAZLLRB-UHFFFAOYSA-N
MW209.20 g/mol
LogP1.79
Rot. Bonds2

About 1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine

1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine (PubChem CID 60783235) has the molecular formula C10H9F2N3 and a molecular weight of 209.20 g/mol. Its IUPAC name is 1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine.

Molecular Properties

Compound Name1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine
PubChem CID60783235
Molecular FormulaC10H9F2N3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC Name1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine
SMILESNc1ccn(Cc2cccc(F)c2F)n1
InChIInChI=1S/C10H9F2N3/c11-8-3-1-2-7(10(8)12)6-15-5-4-9(13)14-15/h1-5H,6H2,(H2,13,14)
InChIKeyDDBZXFPNAZLLRB-UHFFFAOYSA-N
XLogP1.79
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2-fluoro-3-methylphenyl)methyl]pyrazol-3-amine
CID 66752411
1-[(2,4-difluorophenyl)methyl]pyrazol-3-amine
CID 50999564
1-[(2-bromophenyl)methyl]pyrazol-3-amine
CID 60783201
2-[(2,3-difluorophenyl)methyl]triazol-4-amine
CID 165479947
1-[(2-chloro-5-fluorophenyl)methyl]pyrazol-3-amine
CID 102616038
[1-[(3-chloro-2-fluorophenyl)methyl]pyrazol-3-yl]methanamine
CID 102861719
1-[(2,5-dichlorophenyl)methyl]pyrazol-3-amine
CID 42281976
(2-fluorophenyl)methyl 2-(3-aminopyrazol-1-yl)acetate
CID 55035595
methyl 4-amino-1-[(2,3-difluorophenyl)methyl]pyrazole-3-carboxylate
CID 107344693
2-(3-aminopyrazol-1-yl)-N-[(2-fluorophenyl)methyl]acetamide
CID 55035632
(2,3-difluorophenyl)methanamine
CID 2736941
1-[(2,3-difluorophenyl)methyl]-3,5-diethylpyrazol-4-amine
CID 82702759

Frequently Asked Questions

What is the IUPAC name of 1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine?
The IUPAC name of 1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine (CID 60783235) is 1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine.
What is the SMILES notation for 1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine?
The canonical SMILES for 1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine is Nc1ccn(Cc2cccc(F)c2F)n1.
What is the InChIKey of 1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine?
The InChIKey is DDBZXFPNAZLLRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N3/c11-8-3-1-2-7(10(8)12)6-15-5-4-9(13)14-15/h1-5H,6H2,(H2,13,14).
What are the key properties of 1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine?
1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine has a molecular weight of 209.20 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,3-difluorophenyl)methyl]pyrazol-3-amine is sourced from PubChem (CID 60783235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).