6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide

C17H20N2O3 — CID 59995050

IUPAC6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cccc2cc(O)ccc12
InChIInChI=1S/C17H20N2O3/c20-14-4-5-15-13(12-14)2-1-3-16(15)17(21)18-6-7-19-8-10-22-11-9-19/h1-5,12,20H,6-11H2,(H,18,21)
InChIKeyCIFVSUMWOLLUOB-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.61
Rot. Bonds4

About 6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide

6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide (PubChem CID 59995050) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide.

Molecular Properties

Compound Name6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide
PubChem CID59995050
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cccc2cc(O)ccc12
InChIInChI=1S/C17H20N2O3/c20-14-4-5-15-13(12-14)2-1-3-16(15)17(21)18-6-7-19-8-10-22-11-9-19/h1-5,12,20H,6-11H2,(H,18,21)
InChIKeyCIFVSUMWOLLUOB-UHFFFAOYSA-N
XLogP1.61
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide?
The IUPAC name of 6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide (CID 59995050) is 6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide.
What is the SMILES notation for 6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide?
The canonical SMILES for 6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide is O=C(NCCN1CCOCC1)c1cccc2cc(O)ccc12.
What is the InChIKey of 6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide?
The InChIKey is CIFVSUMWOLLUOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c20-14-4-5-15-13(12-14)2-1-3-16(15)17(21)18-6-7-19-8-10-22-11-9-19/h1-5,12,20H,6-11H2,(H,18,21).
What are the key properties of 6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide?
6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 1.61, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide is sourced from PubChem (CID 59995050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).