1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine

C12H19N3 — CID 63318846

IUPAC1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine
SMILESCCc1cc(C2CC2)nc(C(N)CC)n1
InChIInChI=1S/C12H19N3/c1-3-9-7-11(8-5-6-8)15-12(14-9)10(13)4-2/h7-8,10H,3-6,13H2,1-2H3
InChIKeyLYFLXEVMQRWIMK-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.33
Rot. Bonds4

About 1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine

1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine (PubChem CID 63318846) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine.

Molecular Properties

Compound Name1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine
PubChem CID63318846
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC Name1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine
SMILESCCc1cc(C2CC2)nc(C(N)CC)n1
InChIInChI=1S/C12H19N3/c1-3-9-7-11(8-5-6-8)15-12(14-9)10(13)4-2/h7-8,10H,3-6,13H2,1-2H3
InChIKeyLYFLXEVMQRWIMK-UHFFFAOYSA-N
XLogP2.33
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine?
The IUPAC name of 1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine (CID 63318846) is 1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine.
What is the SMILES notation for 1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine?
The canonical SMILES for 1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine is CCc1cc(C2CC2)nc(C(N)CC)n1.
What is the InChIKey of 1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine?
The InChIKey is LYFLXEVMQRWIMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-3-9-7-11(8-5-6-8)15-12(14-9)10(13)4-2/h7-8,10H,3-6,13H2,1-2H3.
What are the key properties of 1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine?
1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine has a molecular weight of 205.30 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopropyl-6-ethylpyrimidin-2-yl)propan-1-amine is sourced from PubChem (CID 63318846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).