6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine

C10H14FN3 — CID 166603002

IUPAC6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine
SMILESCC(C)Nc1ncnc(C2CC2)c1F
InChIInChI=1S/C10H14FN3/c1-6(2)14-10-8(11)9(7-3-4-7)12-5-13-10/h5-7H,3-4H2,1-2H3,(H,12,13,14)
InChIKeyGFTPKXGSTXPMPK-UHFFFAOYSA-N
MW195.24 g/mol
LogP2.31
Rot. Bonds3

About 6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine

6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine (PubChem CID 166603002) has the molecular formula C10H14FN3 and a molecular weight of 195.24 g/mol. Its IUPAC name is 6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine
PubChem CID166603002
Molecular FormulaC10H14FN3
Molecular Weight195.24 g/mol
Exact Mass195.12
IUPAC Name6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine
SMILESCC(C)Nc1ncnc(C2CC2)c1F
InChIInChI=1S/C10H14FN3/c1-6(2)14-10-8(11)9(7-3-4-7)12-5-13-10/h5-7H,3-4H2,1-2H3,(H,12,13,14)
InChIKeyGFTPKXGSTXPMPK-UHFFFAOYSA-N
XLogP2.31
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine (CID 166603002) is 6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine is CC(C)Nc1ncnc(C2CC2)c1F.
What is the InChIKey of 6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine?
The InChIKey is GFTPKXGSTXPMPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3/c1-6(2)14-10-8(11)9(7-3-4-7)12-5-13-10/h5-7H,3-4H2,1-2H3,(H,12,13,14).
What are the key properties of 6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine?
6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine has a molecular weight of 195.24 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-5-fluoro-N-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 166603002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).