4-ethoxy-6-fluoropyrimidin-2-amine

C6H8FN3O — CID 14717225

IUPAC4-ethoxy-6-fluoropyrimidin-2-amine
SMILESCCOc1cc(F)nc(N)n1
InChIInChI=1S/C6H8FN3O/c1-2-11-5-3-4(7)9-6(8)10-5/h3H,2H2,1H3,(H2,8,9,10)
InChIKeyQTOMHAAQQHRLAF-UHFFFAOYSA-N
MW157.15 g/mol
LogP0.60
Rot. Bonds2

About 4-ethoxy-6-fluoropyrimidin-2-amine

4-ethoxy-6-fluoropyrimidin-2-amine (PubChem CID 14717225) has the molecular formula C6H8FN3O and a molecular weight of 157.15 g/mol. Its IUPAC name is 4-ethoxy-6-fluoropyrimidin-2-amine.

Molecular Properties

Compound Name4-ethoxy-6-fluoropyrimidin-2-amine
PubChem CID14717225
Molecular FormulaC6H8FN3O
Molecular Weight157.15 g/mol
Exact Mass157.07
IUPAC Name4-ethoxy-6-fluoropyrimidin-2-amine
SMILESCCOc1cc(F)nc(N)n1
InChIInChI=1S/C6H8FN3O/c1-2-11-5-3-4(7)9-6(8)10-5/h3H,2H2,1H3,(H2,8,9,10)
InChIKeyQTOMHAAQQHRLAF-UHFFFAOYSA-N
XLogP0.60
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.15
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-4,6-dimethoxypyrimidine
CID 118946
2-Pyrimidinamine, 4-chloro-6-methoxy-
CID 79811
2,6-Dimethoxy-4-aminopyrimidine
CID 76789
2,4,6-Trimethoxypyrimidine
CID 726938
2,4-Diamino-6-methoxypyrimidine
CID 816925
2-Amino-6-fluoro-4-methoxypyrimidine
CID 759140
6-Methoxy-2-methylpyrimidin-4-amine
CID 549435
Pyrimidine, 2,4-diamino-6-(2-(dimethylamino)ethoxy)-
CID 202116
Pyrimidine, 2,4-diamino-6-(2-(diethylamino)ethoxy)-
CID 202117
4-Fluoro-2,6-dimethoxypyrimidine
CID 594067
4,6-dimethoxy-N-methylpyrimidin-2-amine
CID 676475
2-Amino-4,6-bis(2,2,2-trifluoroethoxy)pyrimidine
CID 4334263

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-6-fluoropyrimidin-2-amine?
The IUPAC name of 4-ethoxy-6-fluoropyrimidin-2-amine (CID 14717225) is 4-ethoxy-6-fluoropyrimidin-2-amine.
What is the SMILES notation for 4-ethoxy-6-fluoropyrimidin-2-amine?
The canonical SMILES for 4-ethoxy-6-fluoropyrimidin-2-amine is CCOc1cc(F)nc(N)n1.
What is the InChIKey of 4-ethoxy-6-fluoropyrimidin-2-amine?
The InChIKey is QTOMHAAQQHRLAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8FN3O/c1-2-11-5-3-4(7)9-6(8)10-5/h3H,2H2,1H3,(H2,8,9,10).
What are the key properties of 4-ethoxy-6-fluoropyrimidin-2-amine?
4-ethoxy-6-fluoropyrimidin-2-amine has a molecular weight of 157.15 g/mol, XLogP of 0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-6-fluoropyrimidin-2-amine is sourced from PubChem (CID 14717225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).