CID 10987067

C12H16NO — CID 10987067

IUPAC—
SMILESCC1(C)c2ccccc2C(C)(C)N1[O]
InChIInChI=1S/C12H16NO/c1-11(2)9-7-5-6-8-10(9)12(3,4)13(11)14/h5-8H,1-4H3
InChIKeyXWTBMUIROLHFGV-UHFFFAOYSA-N
MW190.27 g/mol
LogP2.82
Rot. Bonds

About CID 10987067

CID 10987067 (PubChem CID 10987067) has the molecular formula C12H16NO and a molecular weight of 190.27 g/mol.

Molecular Properties

Compound NameCID 10987067
PubChem CID10987067
Molecular FormulaC12H16NO
Molecular Weight190.27 g/mol
Exact Mass190.12
IUPAC Name—
SMILESCC1(C)c2ccccc2C(C)(C)N1[O]
InChIInChI=1S/C12H16NO/c1-11(2)9-7-5-6-8-10(9)12(3,4)13(11)14/h5-8H,1-4H3
InChIKeyXWTBMUIROLHFGV-UHFFFAOYSA-N
XLogP2.82
TPSA23.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 10987067?
The IUPAC name of CID 10987067 (CID 10987067) is not available.
What is the SMILES notation for CID 10987067?
The canonical SMILES for CID 10987067 is CC1(C)c2ccccc2C(C)(C)N1[O].
What is the InChIKey of CID 10987067?
The InChIKey is XWTBMUIROLHFGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16NO/c1-11(2)9-7-5-6-8-10(9)12(3,4)13(11)14/h5-8H,1-4H3.
What are the key properties of CID 10987067?
CID 10987067 has a molecular weight of 190.27 g/mol, XLogP of 2.82, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10987067 is sourced from PubChem (CID 10987067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).