CID 100960387

C15H20NO — CID 100960387

IUPAC—
SMILESCC1(C)C=C(c2ccccc2)CC(C)(C)N1[O]
InChIInChI=1S/C15H20NO/c1-14(2)10-13(11-15(3,4)16(14)17)12-8-6-5-7-9-12/h5-10H,11H2,1-4H3
InChIKeyHAYPWPCAEYZFHV-UHFFFAOYSA-N
MW230.33 g/mol
LogP3.68
Rot. Bonds1

About CID 100960387

CID 100960387 (PubChem CID 100960387) has the molecular formula C15H20NO and a molecular weight of 230.33 g/mol.

Molecular Properties

Compound NameCID 100960387
PubChem CID100960387
Molecular FormulaC15H20NO
Molecular Weight230.33 g/mol
Exact Mass230.15
IUPAC Name—
SMILESCC1(C)C=C(c2ccccc2)CC(C)(C)N1[O]
InChIInChI=1S/C15H20NO/c1-14(2)10-13(11-15(3,4)16(14)17)12-8-6-5-7-9-12/h5-10H,11H2,1-4H3
InChIKeyHAYPWPCAEYZFHV-UHFFFAOYSA-N
XLogP3.68
TPSA23.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.33
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 100960387?
The IUPAC name of CID 100960387 (CID 100960387) is not available.
What is the SMILES notation for CID 100960387?
The canonical SMILES for CID 100960387 is CC1(C)C=C(c2ccccc2)CC(C)(C)N1[O].
What is the InChIKey of CID 100960387?
The InChIKey is HAYPWPCAEYZFHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20NO/c1-14(2)10-13(11-15(3,4)16(14)17)12-8-6-5-7-9-12/h5-10H,11H2,1-4H3.
What are the key properties of CID 100960387?
CID 100960387 has a molecular weight of 230.33 g/mol, XLogP of 3.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 100960387 is sourced from PubChem (CID 100960387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).