4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine

C14H22N4 — CID 123688662

IUPAC4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine
SMILESC=C1N=C(C2CC2)C=C(N2CCN(C)CC2)N1C
InChIInChI=1S/C14H22N4/c1-11-15-13(12-4-5-12)10-14(17(11)3)18-8-6-16(2)7-9-18/h10,12H,1,4-9H2,2-3H3
InChIKeyGVIZYNZDPUTNMY-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.34
Rot. Bonds2

About 4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine

4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine (PubChem CID 123688662) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine.

Molecular Properties

Compound Name4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine
PubChem CID123688662
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine
SMILESC=C1N=C(C2CC2)C=C(N2CCN(C)CC2)N1C
InChIInChI=1S/C14H22N4/c1-11-15-13(12-4-5-12)10-14(17(11)3)18-8-6-16(2)7-9-18/h10,12H,1,4-9H2,2-3H3
InChIKeyGVIZYNZDPUTNMY-UHFFFAOYSA-N
XLogP1.34
TPSA22.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine?
The IUPAC name of 4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine (CID 123688662) is 4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine.
What is the SMILES notation for 4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine?
The canonical SMILES for 4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine is C=C1N=C(C2CC2)C=C(N2CCN(C)CC2)N1C.
What is the InChIKey of 4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine?
The InChIKey is GVIZYNZDPUTNMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-11-15-13(12-4-5-12)10-14(17(11)3)18-8-6-16(2)7-9-18/h10,12H,1,4-9H2,2-3H3.
What are the key properties of 4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine?
4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine has a molecular weight of 246.36 g/mol, XLogP of 1.34, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-1-methyl-2-methylidene-6-(4-methylpiperazin-1-yl)pyrimidine is sourced from PubChem (CID 123688662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).