CID 10754745

C17H25N2O — CID 10754745

IUPAC—
SMILESCN(CC1=CC(C)(C)N([O])C1(C)C)Cc1ccccc1
InChIInChI=1S/C17H25N2O/c1-16(2)11-15(17(3,4)19(16)20)13-18(5)12-14-9-7-6-8-10-14/h6-11H,12-13H2,1-5H3
InChIKeyHVHSHPSXOIFCFK-UHFFFAOYSA-N
MW273.40 g/mol
LogP3.26
Rot. Bonds4

About CID 10754745

CID 10754745 (PubChem CID 10754745) has the molecular formula C17H25N2O and a molecular weight of 273.40 g/mol.

Molecular Properties

Compound NameCID 10754745
PubChem CID10754745
Molecular FormulaC17H25N2O
Molecular Weight273.40 g/mol
Exact Mass273.20
IUPAC Name—
SMILESCN(CC1=CC(C)(C)N([O])C1(C)C)Cc1ccccc1
InChIInChI=1S/C17H25N2O/c1-16(2)11-15(17(3,4)19(16)20)13-18(5)12-14-9-7-6-8-10-14/h6-11H,12-13H2,1-5H3
InChIKeyHVHSHPSXOIFCFK-UHFFFAOYSA-N
XLogP3.26
TPSA26.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.40
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 10754745?
The IUPAC name of CID 10754745 (CID 10754745) is not available.
What is the SMILES notation for CID 10754745?
The canonical SMILES for CID 10754745 is CN(CC1=CC(C)(C)N([O])C1(C)C)Cc1ccccc1.
What is the InChIKey of CID 10754745?
The InChIKey is HVHSHPSXOIFCFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N2O/c1-16(2)11-15(17(3,4)19(16)20)13-18(5)12-14-9-7-6-8-10-14/h6-11H,12-13H2,1-5H3.
What are the key properties of CID 10754745?
CID 10754745 has a molecular weight of 273.40 g/mol, XLogP of 3.26, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10754745 is sourced from PubChem (CID 10754745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).