CID 11243500

C16H19N4O2 — CID 11243500

IUPAC—
SMILESCC1(C)C=C(c2nc3c(C(N)=O)cccc3[nH]2)C(C)(C)N1[O]
InChIInChI=1S/C16H19N4O2/c1-15(2)8-10(16(3,4)20(15)22)14-18-11-7-5-6-9(13(17)21)12(11)19-14/h5-8H,1-4H3,(H2,17,21)(H,18,19)
InChIKeyUOSLONPTBPANJW-UHFFFAOYSA-N
MW299.35 g/mol
LogP2.26
Rot. Bonds2

About CID 11243500

CID 11243500 (PubChem CID 11243500) has the molecular formula C16H19N4O2 and a molecular weight of 299.35 g/mol.

Molecular Properties

Compound NameCID 11243500
PubChem CID11243500
Molecular FormulaC16H19N4O2
Molecular Weight299.35 g/mol
Exact Mass299.15
IUPAC Name—
SMILESCC1(C)C=C(c2nc3c(C(N)=O)cccc3[nH]2)C(C)(C)N1[O]
InChIInChI=1S/C16H19N4O2/c1-15(2)8-10(16(3,4)20(15)22)14-18-11-7-5-6-9(13(17)21)12(11)19-14/h5-8H,1-4H3,(H2,17,21)(H,18,19)
InChIKeyUOSLONPTBPANJW-UHFFFAOYSA-N
XLogP2.26
TPSA94.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.35
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 11243500?
The IUPAC name of CID 11243500 (CID 11243500) is not available.
What is the SMILES notation for CID 11243500?
The canonical SMILES for CID 11243500 is CC1(C)C=C(c2nc3c(C(N)=O)cccc3[nH]2)C(C)(C)N1[O].
What is the InChIKey of CID 11243500?
The InChIKey is UOSLONPTBPANJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N4O2/c1-15(2)8-10(16(3,4)20(15)22)14-18-11-7-5-6-9(13(17)21)12(11)19-14/h5-8H,1-4H3,(H2,17,21)(H,18,19).
What are the key properties of CID 11243500?
CID 11243500 has a molecular weight of 299.35 g/mol, XLogP of 2.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11243500 is sourced from PubChem (CID 11243500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).