CID 58718232

C13H13N — CID 58718232

IUPAC—
SMILES[CH]C1=CC2c3ccccc3CN2CC1
InChIInChI=1S/C13H13N/c1-10-6-7-14-9-11-4-2-3-5-12(11)13(14)8-10/h1-5,8,13H,6-7,9H2
InChIKeyIWMRZIUPKWAGMI-UHFFFAOYSA-N
MW183.25 g/mol
LogP2.58
Rot. Bonds

About CID 58718232

CID 58718232 (PubChem CID 58718232) has the molecular formula C13H13N and a molecular weight of 183.25 g/mol.

Molecular Properties

Compound NameCID 58718232
PubChem CID58718232
Molecular FormulaC13H13N
Molecular Weight183.25 g/mol
Exact Mass183.10
IUPAC Name—
SMILES[CH]C1=CC2c3ccccc3CN2CC1
InChIInChI=1S/C13H13N/c1-10-6-7-14-9-11-4-2-3-5-12(11)13(14)8-10/h1-5,8,13H,6-7,9H2
InChIKeyIWMRZIUPKWAGMI-UHFFFAOYSA-N
XLogP2.58
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 58718232?
The IUPAC name of CID 58718232 (CID 58718232) is not available.
What is the SMILES notation for CID 58718232?
The canonical SMILES for CID 58718232 is [CH]C1=CC2c3ccccc3CN2CC1.
What is the InChIKey of CID 58718232?
The InChIKey is IWMRZIUPKWAGMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N/c1-10-6-7-14-9-11-4-2-3-5-12(11)13(14)8-10/h1-5,8,13H,6-7,9H2.
What are the key properties of CID 58718232?
CID 58718232 has a molecular weight of 183.25 g/mol, XLogP of 2.58, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58718232 is sourced from PubChem (CID 58718232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).