2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine

C10H16N2 — CID 149129602

IUPAC2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine
SMILESCC(C)C1C=CNC(C2CC2)=N1
InChIInChI=1S/C10H16N2/c1-7(2)9-5-6-11-10(12-9)8-3-4-8/h5-9H,3-4H2,1-2H3,(H,11,12)
InChIKeyRCCZWVPSEFASET-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.94
Rot. Bonds2

About 2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine

2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine (PubChem CID 149129602) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine.

Molecular Properties

Compound Name2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine
PubChem CID149129602
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine
SMILESCC(C)C1C=CNC(C2CC2)=N1
InChIInChI=1S/C10H16N2/c1-7(2)9-5-6-11-10(12-9)8-3-4-8/h5-9H,3-4H2,1-2H3,(H,11,12)
InChIKeyRCCZWVPSEFASET-UHFFFAOYSA-N
XLogP1.94
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine?
The IUPAC name of 2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine (CID 149129602) is 2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine.
What is the SMILES notation for 2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine?
The canonical SMILES for 2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine is CC(C)C1C=CNC(C2CC2)=N1.
What is the InChIKey of 2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine?
The InChIKey is RCCZWVPSEFASET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-7(2)9-5-6-11-10(12-9)8-3-4-8/h5-9H,3-4H2,1-2H3,(H,11,12).
What are the key properties of 2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine?
2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine has a molecular weight of 164.25 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-propan-2-yl-1,4-dihydropyrimidine is sourced from PubChem (CID 149129602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).