3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine

C9H11FN2 — CID 114617514

IUPAC3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine
SMILESC=C(C)CNc1ncccc1F
InChIInChI=1S/C9H11FN2/c1-7(2)6-12-9-8(10)4-3-5-11-9/h3-5H,1,6H2,2H3,(H,11,12)
InChIKeyRAMYEEYRXZEUJA-UHFFFAOYSA-N
MW166.20 g/mol
LogP2.21
Rot. Bonds3

About 3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine

3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine (PubChem CID 114617514) has the molecular formula C9H11FN2 and a molecular weight of 166.20 g/mol. Its IUPAC name is 3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine.

Molecular Properties

Compound Name3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine
PubChem CID114617514
Molecular FormulaC9H11FN2
Molecular Weight166.20 g/mol
Exact Mass166.09
IUPAC Name3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine
SMILESC=C(C)CNc1ncccc1F
InChIInChI=1S/C9H11FN2/c1-7(2)6-12-9-8(10)4-3-5-11-9/h3-5H,1,6H2,2H3,(H,11,12)
InChIKeyRAMYEEYRXZEUJA-UHFFFAOYSA-N
XLogP2.21
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-chloro-N-(2-methylprop-2-enyl)pyridin-2-amine
CID 114617517
2-(2-methylprop-2-enylamino)pyridine-3-carbonitrile
CID 114617287
2-[(3-fluoro-2-pyridinyl)amino]-N,N-dimethylacetamide
CID 62734537
methyl 2-(2-methylprop-2-enylamino)pyridine-3-carboxylate
CID 114617741
3,5-difluoro-N-(2-methylprop-2-enyl)pyridin-2-amine
CID 114617532
3-chloro-N-(2-methylprop-2-enyl)pyrazin-2-amine
CID 106196773
N,N-diethyl-3-[(3-fluoro-2-pyridinyl)amino]propanamide
CID 62734354
3-[(3-fluoro-2-pyridinyl)amino]-N-methylpropanamide
CID 62732862
[4-[[(3-fluoro-2-pyridinyl)amino]methyl]phenyl]methanol
CID 107232296
1-(dimethylamino)-3-[(3-fluoro-2-pyridinyl)amino]-2-methylpropan-2-ol
CID 103837833
3-fluoro-N-[2-(2-methylpropoxy)ethyl]pyridin-2-amine
CID 115684649
3-fluoro-N-(pyridin-2-ylmethyl)pyridin-2-amine
CID 62733415

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine?
The IUPAC name of 3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine (CID 114617514) is 3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine.
What is the SMILES notation for 3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine?
The canonical SMILES for 3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine is C=C(C)CNc1ncccc1F.
What is the InChIKey of 3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine?
The InChIKey is RAMYEEYRXZEUJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2/c1-7(2)6-12-9-8(10)4-3-5-11-9/h3-5H,1,6H2,2H3,(H,11,12).
What are the key properties of 3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine?
3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine has a molecular weight of 166.20 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(2-methylprop-2-enyl)pyridin-2-amine is sourced from PubChem (CID 114617514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).