3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine

C11H18FN3 — CID 112564015

IUPAC3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine
SMILESCC(C)n1ccc(CC2(F)CC(N)C2)n1
InChIInChI=1S/C11H18FN3/c1-8(2)15-4-3-10(14-15)7-11(12)5-9(13)6-11/h3-4,8-9H,5-7,13H2,1-2H3
InChIKeyDVIKLDVLDCYIOO-UHFFFAOYSA-N
MW211.28 g/mol
LogP1.84
Rot. Bonds3

About 3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine

3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine (PubChem CID 112564015) has the molecular formula C11H18FN3 and a molecular weight of 211.28 g/mol. Its IUPAC name is 3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine
PubChem CID112564015
Molecular FormulaC11H18FN3
Molecular Weight211.28 g/mol
Exact Mass211.15
IUPAC Name3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine
SMILESCC(C)n1ccc(CC2(F)CC(N)C2)n1
InChIInChI=1S/C11H18FN3/c1-8(2)15-4-3-10(14-15)7-11(12)5-9(13)6-11/h3-4,8-9H,5-7,13H2,1-2H3
InChIKeyDVIKLDVLDCYIOO-UHFFFAOYSA-N
XLogP1.84
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.28
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine 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

1-[1-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclopropyl]ethanol
CID 106798253
8-[(1-propan-2-ylpyrazol-3-yl)methyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 64771332
3-[(1-propan-2-ylpyrazol-3-yl)methyl]oxolan-3-amine
CID 65020049
[2-[(1-propan-2-ylpyrazol-3-yl)methyl]-1,3-dihydroinden-2-yl]methanamine
CID 65408274
4-[(1-propan-2-ylpyrazol-3-yl)methyl]oxan-4-ol
CID 64772234
1-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclohexane-1-carbonitrile
CID 65377213
[1-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidin-4-yl]methanamine
CID 64771254
3-amino-1-[(1-methylpyrazol-3-yl)methyl]cyclobutan-1-ol
CID 82868484
3-[[4-butyl-1-(chloromethyl)cyclohexyl]methyl]-1-propan-2-ylpyrazole
CID 66033963
1-(3-aminocyclohexyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanone
CID 116568846
1-(1-methoxycyclopentyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 104610783
4-[(1-propan-2-ylpyrazol-3-yl)methylidene]cyclohexan-1-amine
CID 79879585

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine?
The IUPAC name of 3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine (CID 112564015) is 3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine.
What is the SMILES notation for 3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine?
The canonical SMILES for 3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine is CC(C)n1ccc(CC2(F)CC(N)C2)n1.
What is the InChIKey of 3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine?
The InChIKey is DVIKLDVLDCYIOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18FN3/c1-8(2)15-4-3-10(14-15)7-11(12)5-9(13)6-11/h3-4,8-9H,5-7,13H2,1-2H3.
What are the key properties of 3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine?
3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine has a molecular weight of 211.28 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-3-[(1-propan-2-ylpyrazol-3-yl)methyl]cyclobutan-1-amine is sourced from PubChem (CID 112564015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).