azane;carbonic acid;2-methylpropane;pyridine

C11H22N2O6 — CID 174640229

IUPACazane;carbonic acid;2-methylpropane;pyridine
SMILESCC(C)C.N.O=C(O)O.O=C(O)O.c1ccncc1
InChIInChI=1S/C5H5N.C4H10.2CH2O3.H3N/c1-2-4-6-5-3-1;1-4(2)3;2*2-1(3)4;/h1-5H;4H,1-3H3;2*(H2,2,3,4);1H3
InChIKeyMCOJTHPFFKWMQY-UHFFFAOYSA-N
MW278.31 g/mol
LogP3.35
Rot. Bonds

About azane;carbonic acid;2-methylpropane;pyridine

azane;carbonic acid;2-methylpropane;pyridine (PubChem CID 174640229) has the molecular formula C11H22N2O6 and a molecular weight of 278.31 g/mol. Its IUPAC name is azane;carbonic acid;2-methylpropane;pyridine.

Molecular Properties

Compound Nameazane;carbonic acid;2-methylpropane;pyridine
PubChem CID174640229
Molecular FormulaC11H22N2O6
Molecular Weight278.31 g/mol
Exact Mass278.15
IUPAC Nameazane;carbonic acid;2-methylpropane;pyridine
SMILESCC(C)C.N.O=C(O)O.O=C(O)O.c1ccncc1
InChIInChI=1S/C5H5N.C4H10.2CH2O3.H3N/c1-2-4-6-5-3-1;1-4(2)3;2*2-1(3)4;/h1-5H;4H,1-3H3;2*(H2,2,3,4);1H3
InChIKeyMCOJTHPFFKWMQY-UHFFFAOYSA-N
XLogP3.35
TPSA162.95 Ų
H-Bond Donors5
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 53.35
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of azane;carbonic acid;2-methylpropane;pyridine?
The IUPAC name of azane;carbonic acid;2-methylpropane;pyridine (CID 174640229) is azane;carbonic acid;2-methylpropane;pyridine.
What is the SMILES notation for azane;carbonic acid;2-methylpropane;pyridine?
The canonical SMILES for azane;carbonic acid;2-methylpropane;pyridine is CC(C)C.N.O=C(O)O.O=C(O)O.c1ccncc1.
What is the InChIKey of azane;carbonic acid;2-methylpropane;pyridine?
The InChIKey is MCOJTHPFFKWMQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N.C4H10.2CH2O3.H3N/c1-2-4-6-5-3-1;1-4(2)3;2*2-1(3)4;/h1-5H;4H,1-3H3;2*(H2,2,3,4);1H3.
What are the key properties of azane;carbonic acid;2-methylpropane;pyridine?
azane;carbonic acid;2-methylpropane;pyridine has a molecular weight of 278.31 g/mol, XLogP of 3.35, 0 rotatable bonds, 5 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;carbonic acid;2-methylpropane;pyridine is sourced from PubChem (CID 174640229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).