1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide

C17H20N2O2 — CID 90974103

IUPAC1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide
SMILESCc1ccc2cccc(NC(=O)C3(O)CCCCC3)c2n1
InChIInChI=1S/C17H20N2O2/c1-12-8-9-13-6-5-7-14(15(13)18-12)19-16(20)17(21)10-3-2-4-11-17/h5-9,21H,2-4,10-11H2,1H3,(H,19,20)
InChIKeyXMIQOGJJEAJBQW-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.18
Rot. Bonds2

About 1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide

1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide (PubChem CID 90974103) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide
PubChem CID90974103
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide
SMILESCc1ccc2cccc(NC(=O)C3(O)CCCCC3)c2n1
InChIInChI=1S/C17H20N2O2/c1-12-8-9-13-6-5-7-14(15(13)18-12)19-16(20)17(21)10-3-2-4-11-17/h5-9,21H,2-4,10-11H2,1H3,(H,19,20)
InChIKeyXMIQOGJJEAJBQW-UHFFFAOYSA-N
XLogP3.18
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide?
The IUPAC name of 1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide (CID 90974103) is 1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide is Cc1ccc2cccc(NC(=O)C3(O)CCCCC3)c2n1.
What is the InChIKey of 1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide?
The InChIKey is XMIQOGJJEAJBQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12-8-9-13-6-5-7-14(15(13)18-12)19-16(20)17(21)10-3-2-4-11-17/h5-9,21H,2-4,10-11H2,1H3,(H,19,20).
What are the key properties of 1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide?
1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 3.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 90974103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).