2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine

C14H16FN3 — CID 62191788

IUPAC2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine
SMILESCCCc1cc(NC)nc(-c2ccc(F)cc2)n1
InChIInChI=1S/C14H16FN3/c1-3-4-12-9-13(16-2)18-14(17-12)10-5-7-11(15)8-6-10/h5-9H,3-4H2,1-2H3,(H,16,17,18)
InChIKeyDMFUMFLZPNFEQF-UHFFFAOYSA-N
MW245.30 g/mol
LogP3.28
Rot. Bonds4

About 2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine

2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine (PubChem CID 62191788) has the molecular formula C14H16FN3 and a molecular weight of 245.30 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine
PubChem CID62191788
Molecular FormulaC14H16FN3
Molecular Weight245.30 g/mol
Exact Mass245.13
IUPAC Name2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine
SMILESCCCc1cc(NC)nc(-c2ccc(F)cc2)n1
InChIInChI=1S/C14H16FN3/c1-3-4-12-9-13(16-2)18-14(17-12)10-5-7-11(15)8-6-10/h5-9H,3-4H2,1-2H3,(H,16,17,18)
InChIKeyDMFUMFLZPNFEQF-UHFFFAOYSA-N
XLogP3.28
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-chloro-4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 63484860
2-(3-chloro-5-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 114454521
N-methyl-6-propyl-2-pyridin-3-ylpyrimidin-4-amine
CID 62191790
2-(4-bromo-3,5-dimethylphenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 114330950
2-[4-(difluoromethyl)phenyl]-6-ethyl-N-methylpyrimidin-4-amine
CID 115525281
2-(2-bromo-3,4-difluorophenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 107539712
N-ethyl-2-(3-fluoro-4-methylphenyl)-6-propylpyrimidin-4-amine
CID 63486628
(2-phenyl-6-propylpyrimidin-4-yl)hydrazine
CID 62252370
2-(2,4-dichlorophenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 63480481
N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine
CID 63222525
2-(4-bromo-2-methylphenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 103083742
2-(4-fluorophenyl)-N-methylpyrimidin-4-amine
CID 62190613

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine?
The IUPAC name of 2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine (CID 62191788) is 2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine?
The canonical SMILES for 2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine is CCCc1cc(NC)nc(-c2ccc(F)cc2)n1.
What is the InChIKey of 2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine?
The InChIKey is DMFUMFLZPNFEQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3/c1-3-4-12-9-13(16-2)18-14(17-12)10-5-7-11(15)8-6-10/h5-9H,3-4H2,1-2H3,(H,16,17,18).
What are the key properties of 2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine?
2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine has a molecular weight of 245.30 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine is sourced from PubChem (CID 62191788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).