2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine

C10H14N2 — CID 145287245

IUPAC2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine
SMILESC=C1NC(C)=NC(/C=C\C)=C1C
InChIInChI=1S/C10H14N2/c1-5-6-10-7(2)8(3)11-9(4)12-10/h5-6H,3H2,1-2,4H3,(H,11,12)/b6-5-
InChIKeyXOYYYMDSESEYHR-WAYWQWQTSA-N
MW162.24 g/mol
LogP2.37
Rot. Bonds1

About 2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine

2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine (PubChem CID 145287245) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine.

Molecular Properties

Compound Name2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine
PubChem CID145287245
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine
SMILESC=C1NC(C)=NC(/C=C\C)=C1C
InChIInChI=1S/C10H14N2/c1-5-6-10-7(2)8(3)11-9(4)12-10/h5-6H,3H2,1-2,4H3,(H,11,12)/b6-5-
InChIKeyXOYYYMDSESEYHR-WAYWQWQTSA-N
XLogP2.37
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine?
The IUPAC name of 2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine (CID 145287245) is 2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine.
What is the SMILES notation for 2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine?
The canonical SMILES for 2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine is C=C1NC(C)=NC(/C=C\C)=C1C.
What is the InChIKey of 2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine?
The InChIKey is XOYYYMDSESEYHR-WAYWQWQTSA-N. The full InChI is InChI=1S/C10H14N2/c1-5-6-10-7(2)8(3)11-9(4)12-10/h5-6H,3H2,1-2,4H3,(H,11,12)/b6-5-.
What are the key properties of 2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine?
2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine has a molecular weight of 162.24 g/mol, XLogP of 2.37, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-6-methylidene-4-[(Z)-prop-1-enyl]-1H-pyrimidine is sourced from PubChem (CID 145287245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).