1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine

C10H16N2 — CID 170093998

IUPAC1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine
SMILESC=C1C=C(C(C)C)N=C(C)N1C
InChIInChI=1S/C10H16N2/c1-7(2)10-6-8(3)12(5)9(4)11-10/h6-7H,3H2,1-2,4-5H3
InChIKeyKJNZLXQJIAAXRM-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.40
Rot. Bonds1

About 1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine

1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine (PubChem CID 170093998) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine.

Molecular Properties

Compound Name1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine
PubChem CID170093998
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine
SMILESC=C1C=C(C(C)C)N=C(C)N1C
InChIInChI=1S/C10H16N2/c1-7(2)10-6-8(3)12(5)9(4)11-10/h6-7H,3H2,1-2,4-5H3
InChIKeyKJNZLXQJIAAXRM-UHFFFAOYSA-N
XLogP2.40
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine?
The IUPAC name of 1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine (CID 170093998) is 1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine.
What is the SMILES notation for 1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine?
The canonical SMILES for 1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine is C=C1C=C(C(C)C)N=C(C)N1C.
What is the InChIKey of 1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine?
The InChIKey is KJNZLXQJIAAXRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-7(2)10-6-8(3)12(5)9(4)11-10/h6-7H,3H2,1-2,4-5H3.
What are the key properties of 1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine?
1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine has a molecular weight of 164.25 g/mol, XLogP of 2.40, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-6-methylidene-4-propan-2-ylpyrimidine is sourced from PubChem (CID 170093998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).