CID 143958487

C16H15 — CID 143958487

IUPAC
SMILESCC1=CC=C(C2=CC=C(C3=C=[C]3)CC2)CC1
InChIInChI=1S/C16H15/c1-12-2-4-13(5-3-12)14-6-8-15(9-7-14)16-10-11-16/h2,4,6,8H,3,5,7,9H2,1H3
InChIKeyNYOANCXZGHFLKN-UHFFFAOYSA-N
MW207.30 g/mol
LogP4.20
Rot. Bonds2

About CID 143958487

CID 143958487 (PubChem CID 143958487) has the molecular formula C16H15 and a molecular weight of 207.30 g/mol.

Molecular Properties

Compound NameCID 143958487
PubChem CID143958487
Molecular FormulaC16H15
Molecular Weight207.30 g/mol
Exact Mass207.12
IUPAC Name
SMILESCC1=CC=C(C2=CC=C(C3=C=[C]3)CC2)CC1
InChIInChI=1S/C16H15/c1-12-2-4-13(5-3-12)14-6-8-15(9-7-14)16-10-11-16/h2,4,6,8H,3,5,7,9H2,1H3
InChIKeyNYOANCXZGHFLKN-UHFFFAOYSA-N
XLogP4.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 143958487?
The IUPAC name of CID 143958487 (CID 143958487) is not available.
What is the SMILES notation for CID 143958487?
The canonical SMILES for CID 143958487 is CC1=CC=C(C2=CC=C(C3=C=[C]3)CC2)CC1.
What is the InChIKey of CID 143958487?
The InChIKey is NYOANCXZGHFLKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15/c1-12-2-4-13(5-3-12)14-6-8-15(9-7-14)16-10-11-16/h2,4,6,8H,3,5,7,9H2,1H3.
What are the key properties of CID 143958487?
CID 143958487 has a molecular weight of 207.30 g/mol, XLogP of 4.20, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 143958487 is sourced from PubChem (CID 143958487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).