[2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine

C14H13FN4O — CID 95474904

IUPAC[2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine
SMILESCOc1ccc(-c2nc3ncccn3c2CN)cc1F
InChIInChI=1S/C14H13FN4O/c1-20-12-4-3-9(7-10(12)15)13-11(8-16)19-6-2-5-17-14(19)18-13/h2-7H,8,16H2,1H3
InChIKeyRKIMNTIYMRQIAP-UHFFFAOYSA-N
MW272.28 g/mol
LogP2.00
Rot. Bonds3

About [2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine

[2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine (PubChem CID 95474904) has the molecular formula C14H13FN4O and a molecular weight of 272.28 g/mol. Its IUPAC name is [2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine
PubChem CID95474904
Molecular FormulaC14H13FN4O
Molecular Weight272.28 g/mol
Exact Mass272.11
IUPAC Name[2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine
SMILESCOc1ccc(-c2nc3ncccn3c2CN)cc1F
InChIInChI=1S/C14H13FN4O/c1-20-12-4-3-9(7-10(12)15)13-11(8-16)19-6-2-5-17-14(19)18-13/h2-7H,8,16H2,1H3
InChIKeyRKIMNTIYMRQIAP-UHFFFAOYSA-N
XLogP2.00
TPSA65.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.28
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine with MolForge

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Related Compounds

2-(3-fluoro-4-methoxyphenyl)-N-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrimidine-3-carboxamide
CID 71553290
2-[2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
CID 82299531
[2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine
CID 82304501
3-[2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]propan-1-amine
CID 170879132
2-[2-(4-chlorophenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
CID 95475392
2-(2-phenylimidazo[1,2-a]pyrimidin-3-yl)ethanamine
CID 82292189
[4-(3-fluoro-4-methoxyphenyl)-2-methyl-1H-imidazol-5-yl]methanamine
CID 82291070
2-(3-fluoro-4-methoxyphenyl)pyrimidine
CID 134263784
[2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
CID 82060633
[4-(3-fluoro-4-methoxyphenyl)pyrimidin-2-yl]methanamine
CID 82475463
[3-amino-2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanol
CID 82355992
2-(3,4-dimethoxyphenyl)-5-[2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]-1,3,4-oxadiazole
CID 155806887

Frequently Asked Questions

What is the IUPAC name of [2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine?
The IUPAC name of [2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine (CID 95474904) is [2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine.
What is the SMILES notation for [2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine?
The canonical SMILES for [2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine is COc1ccc(-c2nc3ncccn3c2CN)cc1F.
What is the InChIKey of [2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine?
The InChIKey is RKIMNTIYMRQIAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN4O/c1-20-12-4-3-9(7-10(12)15)13-11(8-16)19-6-2-5-17-14(19)18-13/h2-7H,8,16H2,1H3.
What are the key properties of [2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine?
[2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine has a molecular weight of 272.28 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine is sourced from PubChem (CID 95474904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).