ethane;propane;pyrimidine

C9H18N2 — CID 91514056

IUPACethane;propane;pyrimidine
SMILESCC.CCC.c1cncnc1
InChIInChI=1S/C4H4N2.C3H8.C2H6/c1-2-5-4-6-3-1;1-3-2;1-2/h1-4H;3H2,1-2H3;1-2H3
InChIKeyXFIUUSCPMOZVGE-UHFFFAOYSA-N
MW154.26 g/mol
LogP2.92
Rot. Bonds

About ethane;propane;pyrimidine

ethane;propane;pyrimidine (PubChem CID 91514056) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is ethane;propane;pyrimidine.

Molecular Properties

Compound Nameethane;propane;pyrimidine
PubChem CID91514056
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Nameethane;propane;pyrimidine
SMILESCC.CCC.c1cncnc1
InChIInChI=1S/C4H4N2.C3H8.C2H6/c1-2-5-4-6-3-1;1-3-2;1-2/h1-4H;3H2,1-2H3;1-2H3
InChIKeyXFIUUSCPMOZVGE-UHFFFAOYSA-N
XLogP2.92
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

propane;bis(pyrimidine)
CID 91609456
pyrimidine;bis(tungsten(2+))
CID 175709201
ethane;methane;propane;1,3,5-triazine
CID 159481307
copper;pyrimidine
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iron;pyrimidine
CID 160776334
benzene;ethane;methane;pyridine;pyrimidine
CID 158253499
ethane;pyrazine;hexakis(pyridine);tris(pyrimidine)
CID 158901508
pyrimidine;trimethylstannane
CID 157412303
pyrimidine;dihydrate;hydrochloride
CID 142797131
pyrimidine;pentahydrate;trihydrochloride
CID 139950322
manganese;pyrimidine;sulfane
CID 174633913
CID 174457230
CID 174457230

Frequently Asked Questions

What is the IUPAC name of ethane;propane;pyrimidine?
The IUPAC name of ethane;propane;pyrimidine (CID 91514056) is ethane;propane;pyrimidine.
What is the SMILES notation for ethane;propane;pyrimidine?
The canonical SMILES for ethane;propane;pyrimidine is CC.CCC.c1cncnc1.
What is the InChIKey of ethane;propane;pyrimidine?
The InChIKey is XFIUUSCPMOZVGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N2.C3H8.C2H6/c1-2-5-4-6-3-1;1-3-2;1-2/h1-4H;3H2,1-2H3;1-2H3.
What are the key properties of ethane;propane;pyrimidine?
ethane;propane;pyrimidine has a molecular weight of 154.26 g/mol, XLogP of 2.92, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;propane;pyrimidine is sourced from PubChem (CID 91514056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).