2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine

C14H20F3N3 — CID 118907918

IUPAC2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine
SMILESCCCN(CCC)c1cc(C(F)(F)F)nc(C2CC2)n1
InChIInChI=1S/C14H20F3N3/c1-3-7-20(8-4-2)12-9-11(14(15,16)17)18-13(19-12)10-5-6-10/h9-10H,3-8H2,1-2H3
InChIKeyLXSGIVPXJZAMGM-UHFFFAOYSA-N
MW287.33 g/mol
LogP4.00
Rot. Bonds6

About 2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine

2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine (PubChem CID 118907918) has the molecular formula C14H20F3N3 and a molecular weight of 287.33 g/mol. Its IUPAC name is 2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine
PubChem CID118907918
Molecular FormulaC14H20F3N3
Molecular Weight287.33 g/mol
Exact Mass287.16
IUPAC Name2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine
SMILESCCCN(CCC)c1cc(C(F)(F)F)nc(C2CC2)n1
InChIInChI=1S/C14H20F3N3/c1-3-7-20(8-4-2)12-9-11(14(15,16)17)18-13(19-12)10-5-6-10/h9-10H,3-8H2,1-2H3
InChIKeyLXSGIVPXJZAMGM-UHFFFAOYSA-N
XLogP4.00
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine (CID 118907918) is 2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine is CCCN(CCC)c1cc(C(F)(F)F)nc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine?
The InChIKey is LXSGIVPXJZAMGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F3N3/c1-3-7-20(8-4-2)12-9-11(14(15,16)17)18-13(19-12)10-5-6-10/h9-10H,3-8H2,1-2H3.
What are the key properties of 2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine?
2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine has a molecular weight of 287.33 g/mol, XLogP of 4.00, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N,N-dipropyl-6-(trifluoromethyl)pyrimidin-4-amine is sourced from PubChem (CID 118907918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).