2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine

C9H8FN3 — CID 177316366

IUPAC2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine
SMILESFc1ccc(C2=NCCC=N2)nc1
InChIInChI=1S/C9H8FN3/c10-7-2-3-8(13-6-7)9-11-4-1-5-12-9/h2-4,6H,1,5H2
InChIKeyPAJCKWGBNJMDNP-UHFFFAOYSA-N
MW177.18 g/mol
LogP1.44
Rot. Bonds1

About 2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine

2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine (PubChem CID 177316366) has the molecular formula C9H8FN3 and a molecular weight of 177.18 g/mol. Its IUPAC name is 2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine.

Molecular Properties

Compound Name2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine
PubChem CID177316366
Molecular FormulaC9H8FN3
Molecular Weight177.18 g/mol
Exact Mass177.07
IUPAC Name2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine
SMILESFc1ccc(C2=NCCC=N2)nc1
InChIInChI=1S/C9H8FN3/c10-7-2-3-8(13-6-7)9-11-4-1-5-12-9/h2-4,6H,1,5H2
InChIKeyPAJCKWGBNJMDNP-UHFFFAOYSA-N
XLogP1.44
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.18
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-4-(5-fluoro-2-pyridinyl)-1,3-thiazole
CID 112623637
4-(chloromethyl)-2-(5-fluoro-2-pyridinyl)-1,3-thiazole
CID 79719140
ethane;3-(5-fluoro-2-pyridinyl)-4,5,6-trimethylpyridazine
CID 169124065
1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 83119834
2-(5-fluoro-2-pyridinyl)pyrimidine-5-carbaldehyde
CID 79717980
5-fluoro-2-(2,4,6-trichlorophenyl)pyridine
CID 133090364
2-(2,4-difluorophenyl)-5-fluoropyridine
CID 130334925
2-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]acetic acid
CID 83131751
2-chloro-5-(5-fluoro-2-pyridinyl)-1,3,4-thiadiazole
CID 104643074
6-(4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)-1,4-dihydropyrimidine
CID 123678257
1-cyclopropyl-N-[[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]methyl]methanamine
CID 83119835
3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazole
CID 123747888

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine?
The IUPAC name of 2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine (CID 177316366) is 2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine.
What is the SMILES notation for 2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine?
The canonical SMILES for 2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine is Fc1ccc(C2=NCCC=N2)nc1.
What is the InChIKey of 2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine?
The InChIKey is PAJCKWGBNJMDNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3/c10-7-2-3-8(13-6-7)9-11-4-1-5-12-9/h2-4,6H,1,5H2.
What are the key properties of 2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine?
2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine has a molecular weight of 177.18 g/mol, XLogP of 1.44, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-pyridinyl)-4,5-dihydropyrimidine is sourced from PubChem (CID 177316366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).