4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine

C6H7FN4 — CID 173427726

IUPAC4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine
SMILESC=CCNc1ncnc(F)n1
InChIInChI=1S/C6H7FN4/c1-2-3-8-6-10-4-9-5(7)11-6/h2,4H,1,3H2,(H,8,9,10,11)
InChIKeyNZLDWZQDTPYHDX-UHFFFAOYSA-N
MW154.15 g/mol
LogP0.61
Rot. Bonds3

About 4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine

4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine (PubChem CID 173427726) has the molecular formula C6H7FN4 and a molecular weight of 154.15 g/mol. Its IUPAC name is 4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine
PubChem CID173427726
Molecular FormulaC6H7FN4
Molecular Weight154.15 g/mol
Exact Mass154.07
IUPAC Name4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine
SMILESC=CCNc1ncnc(F)n1
InChIInChI=1S/C6H7FN4/c1-2-3-8-6-10-4-9-5(7)11-6/h2,4H,1,3H2,(H,8,9,10,11)
InChIKeyNZLDWZQDTPYHDX-UHFFFAOYSA-N
XLogP0.61
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.15
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1,3,5-Triazine-2,4,6-triamine, N,N'-di-2-propenyl-
CID 35075
2-N-prop-2-enyl-1,3,5-triazine-2,4-diamine
CID 10986425
4,6-difluoro-N-prop-2-enyl-1,3,5-triazin-2-amine
CID 70598290
4,6-dichloro-N-(1-fluoroprop-2-enyl)-1,3,5-triazin-2-amine
CID 88719283
4-chloro-6-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine
CID 141655646
4,6-dichloro-N-(3-fluoroprop-2-enyl)-1,3,5-triazin-2-amine
CID 173424704
N~2~-(Prop-2-en-1-yl)-1,3,5-triazine-2,4,6-triamine
CID 15835051
4-chloro-N-prop-2-enyl-1,3,5-triazin-2-amine
CID 20399199
4-N-methyl-2-N-prop-2-enyl-1,3,5-triazine-2,4,6-triamine
CID 22118054
Allyl-[1,3,5]triazin-2-yl-amine
CID 54016589
2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
CID 54418415
4-methoxy-N-prop-2-enyl-1,3,5-triazin-2-amine
CID 66668151

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine (CID 173427726) is 4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine is C=CCNc1ncnc(F)n1.
What is the InChIKey of 4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine?
The InChIKey is NZLDWZQDTPYHDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN4/c1-2-3-8-6-10-4-9-5(7)11-6/h2,4H,1,3H2,(H,8,9,10,11).
What are the key properties of 4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine?
4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine has a molecular weight of 154.15 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-prop-2-enyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 173427726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).