CID 58655955

C11H12N — CID 58655955

IUPAC—
SMILES[CH2]CCn1ccc2ccccc21
InChIInChI=1S/C11H12N/c1-2-8-12-9-7-10-5-3-4-6-11(10)12/h3-7,9H,1-2,8H2
InChIKeyUKPPJPBKXQLUAG-UHFFFAOYSA-N
MW158.22 g/mol
LogP2.87
Rot. Bonds2

About CID 58655955

CID 58655955 (PubChem CID 58655955) has the molecular formula C11H12N and a molecular weight of 158.22 g/mol.

Molecular Properties

Compound NameCID 58655955
PubChem CID58655955
Molecular FormulaC11H12N
Molecular Weight158.22 g/mol
Exact Mass158.10
IUPAC Name—
SMILES[CH2]CCn1ccc2ccccc21
InChIInChI=1S/C11H12N/c1-2-8-12-9-7-10-5-3-4-6-11(10)12/h3-7,9H,1-2,8H2
InChIKeyUKPPJPBKXQLUAG-UHFFFAOYSA-N
XLogP2.87
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.22
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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N-(2-indol-1-ylethyl)cyclopropanamine
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1-(3,6-dimethylheptyl)indole
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Frequently Asked Questions

What is the IUPAC name of CID 58655955?
The IUPAC name of CID 58655955 (CID 58655955) is not available.
What is the SMILES notation for CID 58655955?
The canonical SMILES for CID 58655955 is [CH2]CCn1ccc2ccccc21.
What is the InChIKey of CID 58655955?
The InChIKey is UKPPJPBKXQLUAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N/c1-2-8-12-9-7-10-5-3-4-6-11(10)12/h3-7,9H,1-2,8H2.
What are the key properties of CID 58655955?
CID 58655955 has a molecular weight of 158.22 g/mol, XLogP of 2.87, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58655955 is sourced from PubChem (CID 58655955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).