5-(1-aminoethyl)-2-fluoropyridin-3-amine

C7H10FN3 — CID 55293983

IUPAC5-(1-aminoethyl)-2-fluoropyridin-3-amine
SMILESCC(N)c1cnc(F)c(N)c1
InChIInChI=1S/C7H10FN3/c1-4(9)5-2-6(10)7(8)11-3-5/h2-4H,9-10H2,1H3
InChIKeyWNQOUVCXEFZTIC-UHFFFAOYSA-N
MW155.18 g/mol
LogP0.82
Rot. Bonds1

About 5-(1-aminoethyl)-2-fluoropyridin-3-amine

5-(1-aminoethyl)-2-fluoropyridin-3-amine (PubChem CID 55293983) has the molecular formula C7H10FN3 and a molecular weight of 155.18 g/mol. Its IUPAC name is 5-(1-aminoethyl)-2-fluoropyridin-3-amine.

Molecular Properties

Compound Name5-(1-aminoethyl)-2-fluoropyridin-3-amine
PubChem CID55293983
Molecular FormulaC7H10FN3
Molecular Weight155.18 g/mol
Exact Mass155.09
IUPAC Name5-(1-aminoethyl)-2-fluoropyridin-3-amine
SMILESCC(N)c1cnc(F)c(N)c1
InChIInChI=1S/C7H10FN3/c1-4(9)5-2-6(10)7(8)11-3-5/h2-4H,9-10H2,1H3
InChIKeyWNQOUVCXEFZTIC-UHFFFAOYSA-N
XLogP0.82
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.18
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-[(1R)-1-aminoethyl]-2-fluoropyridin-3-amine
CID 55263086
1-amino-1-(5-amino-6-fluoro-3-pyridinyl)propan-2-ol
CID 55270474
5-(1-aminobutyl)-2-fluoropyridin-3-amine
CID 55294196
(1S)-1-(6-chloro-5-fluoro-3-pyridinyl)ethanamine
CID 90451790
5-[(1R)-1-aminoethyl]-3-bromopyridin-2-amine
CID 130766270
(1R)-1-(5,6-difluoro-3-pyridinyl)-2-methylpropan-1-amine
CID 130623639
CID 89283544
CID 89283544
(1R)-1-(6-iodo-5-methyl-3-pyridinyl)ethanamine
CID 124503157
5-[(1R)-1-aminoethyl]pyridin-3-amine
CID 55275207
(1S)-1-(6-chloro-8-fluoroquinolin-3-yl)ethanamine
CID 154404062
(1S,2S)-1-amino-1-(6-fluoro-5-methyl-3-pyridinyl)propan-2-ol
CID 55292212
(1S)-1-(5-chloro-2-fluoro-3-pyridinyl)ethanamine
CID 130907422

Frequently Asked Questions

What is the IUPAC name of 5-(1-aminoethyl)-2-fluoropyridin-3-amine?
The IUPAC name of 5-(1-aminoethyl)-2-fluoropyridin-3-amine (CID 55293983) is 5-(1-aminoethyl)-2-fluoropyridin-3-amine.
What is the SMILES notation for 5-(1-aminoethyl)-2-fluoropyridin-3-amine?
The canonical SMILES for 5-(1-aminoethyl)-2-fluoropyridin-3-amine is CC(N)c1cnc(F)c(N)c1.
What is the InChIKey of 5-(1-aminoethyl)-2-fluoropyridin-3-amine?
The InChIKey is WNQOUVCXEFZTIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN3/c1-4(9)5-2-6(10)7(8)11-3-5/h2-4H,9-10H2,1H3.
What are the key properties of 5-(1-aminoethyl)-2-fluoropyridin-3-amine?
5-(1-aminoethyl)-2-fluoropyridin-3-amine has a molecular weight of 155.18 g/mol, XLogP of 0.82, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-aminoethyl)-2-fluoropyridin-3-amine is sourced from PubChem (CID 55293983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).