methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine

C17H28N4 — CID 158182176

IUPACmethane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine
SMILESC.CC(C)c1ccnc(N)c1.Cc1ncc(C(C)C)cn1
InChIInChI=1S/2C8H12N2.CH4/c1-6(2)8-4-9-7(3)10-5-8;1-6(2)7-3-4-10-8(9)5-7;/h4-6H,1-3H3;3-6H,1-2H3,(H2,9,10);1H4
InChIKeyFYSOMYOBWDYYBJ-UHFFFAOYSA-N
MW288.44 g/mol
LogP4.33
Rot. Bonds2

About methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine

methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine (PubChem CID 158182176) has the molecular formula C17H28N4 and a molecular weight of 288.44 g/mol. Its IUPAC name is methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Namemethane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine
PubChem CID158182176
Molecular FormulaC17H28N4
Molecular Weight288.44 g/mol
Exact Mass288.23
IUPAC Namemethane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine
SMILESC.CC(C)c1ccnc(N)c1.Cc1ncc(C(C)C)cn1
InChIInChI=1S/2C8H12N2.CH4/c1-6(2)8-4-9-7(3)10-5-8;1-6(2)7-3-4-10-8(9)5-7;/h4-6H,1-3H3;3-6H,1-2H3,(H2,9,10);1H4
InChIKeyFYSOMYOBWDYYBJ-UHFFFAOYSA-N
XLogP4.33
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine?
The IUPAC name of methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine (CID 158182176) is methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine.
What is the SMILES notation for methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine?
The canonical SMILES for methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine is C.CC(C)c1ccnc(N)c1.Cc1ncc(C(C)C)cn1.
What is the InChIKey of methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine?
The InChIKey is FYSOMYOBWDYYBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H12N2.CH4/c1-6(2)8-4-9-7(3)10-5-8;1-6(2)7-3-4-10-8(9)5-7;/h4-6H,1-3H3;3-6H,1-2H3,(H2,9,10);1H4.
What are the key properties of methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine?
methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine has a molecular weight of 288.44 g/mol, XLogP of 4.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-methyl-5-propan-2-ylpyrimidine;4-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 158182176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).