4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide

C17H20N2O3 — CID 21198179

IUPAC4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide
SMILESNC(=O)c1ccc(OCCN2CCOCC2)c2ccccc12
InChIInChI=1S/C17H20N2O3/c18-17(20)15-5-6-16(14-4-2-1-3-13(14)15)22-12-9-19-7-10-21-11-8-19/h1-6H,7-12H2,(H2,18,20)
InChIKeyBYUOSMORXXZHJH-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.65
Rot. Bonds5

About 4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide

4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide (PubChem CID 21198179) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide.

Molecular Properties

Compound Name4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide
PubChem CID21198179
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide
SMILESNC(=O)c1ccc(OCCN2CCOCC2)c2ccccc12
InChIInChI=1S/C17H20N2O3/c18-17(20)15-5-6-16(14-4-2-1-3-13(14)15)22-12-9-19-7-10-21-11-8-19/h1-6H,7-12H2,(H2,18,20)
InChIKeyBYUOSMORXXZHJH-UHFFFAOYSA-N
XLogP1.65
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide?
The IUPAC name of 4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide (CID 21198179) is 4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide.
What is the SMILES notation for 4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide?
The canonical SMILES for 4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide is NC(=O)c1ccc(OCCN2CCOCC2)c2ccccc12.
What is the InChIKey of 4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide?
The InChIKey is BYUOSMORXXZHJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c18-17(20)15-5-6-16(14-4-2-1-3-13(14)15)22-12-9-19-7-10-21-11-8-19/h1-6H,7-12H2,(H2,18,20).
What are the key properties of 4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide?
4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-morpholin-4-ylethoxy)naphthalene-1-carboxamide is sourced from PubChem (CID 21198179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).