5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine

C10H10FN3 — CID 163986258

IUPAC5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine
SMILESNC1N=CNC=C1c1ccc(F)cc1
InChIInChI=1S/C10H10FN3/c11-8-3-1-7(2-4-8)9-5-13-6-14-10(9)12/h1-6,10H,12H2,(H,13,14)
InChIKeyTWPUVXALINUOMD-UHFFFAOYSA-N
MW191.21 g/mol
LogP1.08
Rot. Bonds1

About 5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine

5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine (PubChem CID 163986258) has the molecular formula C10H10FN3 and a molecular weight of 191.21 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine.

Molecular Properties

Compound Name5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine
PubChem CID163986258
Molecular FormulaC10H10FN3
Molecular Weight191.21 g/mol
Exact Mass191.09
IUPAC Name5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine
SMILESNC1N=CNC=C1c1ccc(F)cc1
InChIInChI=1S/C10H10FN3/c11-8-3-1-7(2-4-8)9-5-13-6-14-10(9)12/h1-6,10H,12H2,(H,13,14)
InChIKeyTWPUVXALINUOMD-UHFFFAOYSA-N
XLogP1.08
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.21
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 58320925
2-(4-fluorophenyl)-2,5-dihydro-1H-imidazole
CID 56616688
4-(4-fluorophenyl)pyridazine
CID 174622993
3-[4-(4-fluorophenyl)phenyl]cyclopent-2-en-1-amine
CID 82298493
5-(4-fluorophenyl)-4-methyl-2-phenyl-3,4-dihydropyridine
CID 140708544
3-(4-fluorophenyl)cyclobut-3-ene-1,2-diol
CID 130142404
2,3,5,6-tetrakis(4-fluorophenyl)pyrazine
CID 132966321
3-(4-fluorophenyl)-1,2-dihydropyridin-4-amine
CID 86341374
2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylcyclopentan-1-amine
CID 82762337
3,5-dichloro-4-(4-fluorophenyl)aniline
CID 89422733
2-[4-(4-fluorophenyl)-2,3-dihydro-1H-pyrazol-3-yl]-6-methylpyridine
CID 142876332
1,1-dichloro-4-[4-(4-fluorophenyl)phenyl]silinane
CID 22404089

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine?
The IUPAC name of 5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine (CID 163986258) is 5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine.
What is the SMILES notation for 5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine?
The canonical SMILES for 5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine is NC1N=CNC=C1c1ccc(F)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine?
The InChIKey is TWPUVXALINUOMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3/c11-8-3-1-7(2-4-8)9-5-13-6-14-10(9)12/h1-6,10H,12H2,(H,13,14).
What are the key properties of 5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine?
5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine has a molecular weight of 191.21 g/mol, XLogP of 1.08, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-1,4-dihydropyrimidin-4-amine is sourced from PubChem (CID 163986258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).