CID 59369483

C11H13N3O — CID 59369483

IUPAC
SMILES[CH]c1cncc(C(=O)N(C)CC2CC2)n1
InChIInChI=1S/C11H13N3O/c1-8-5-12-6-10(13-8)11(15)14(2)7-9-3-4-9/h1,5-6,9H,3-4,7H2,2H3
InChIKeySWJIMCNFASTSHN-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.02
Rot. Bonds3

About CID 59369483

CID 59369483 (PubChem CID 59369483) has the molecular formula C11H13N3O and a molecular weight of 203.24 g/mol.

Molecular Properties

Compound NameCID 59369483
PubChem CID59369483
Molecular FormulaC11H13N3O
Molecular Weight203.24 g/mol
Exact Mass203.11
IUPAC Name
SMILES[CH]c1cncc(C(=O)N(C)CC2CC2)n1
InChIInChI=1S/C11H13N3O/c1-8-5-12-6-10(13-8)11(15)14(2)7-9-3-4-9/h1,5-6,9H,3-4,7H2,2H3
InChIKeySWJIMCNFASTSHN-UHFFFAOYSA-N
XLogP1.02
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 59369483?
The IUPAC name of CID 59369483 (CID 59369483) is not available.
What is the SMILES notation for CID 59369483?
The canonical SMILES for CID 59369483 is [CH]c1cncc(C(=O)N(C)CC2CC2)n1.
What is the InChIKey of CID 59369483?
The InChIKey is SWJIMCNFASTSHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-8-5-12-6-10(13-8)11(15)14(2)7-9-3-4-9/h1,5-6,9H,3-4,7H2,2H3.
What are the key properties of CID 59369483?
CID 59369483 has a molecular weight of 203.24 g/mol, XLogP of 1.02, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59369483 is sourced from PubChem (CID 59369483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).