6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide

C18H22N2O2 — CID 142825868

IUPAC6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide
SMILESCc1ccc2cc(C(=O)NCCN3CCOCC3)ccc2c1
InChIInChI=1S/C18H22N2O2/c1-14-2-3-16-13-17(5-4-15(16)12-14)18(21)19-6-7-20-8-10-22-11-9-20/h2-5,12-13H,6-11H2,1H3,(H,19,21)
InChIKeyXZFSJVDJFJIEBH-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.21
Rot. Bonds4

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

6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide (PubChem CID 142825868) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide
PubChem CID142825868
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide
SMILESCc1ccc2cc(C(=O)NCCN3CCOCC3)ccc2c1
InChIInChI=1S/C18H22N2O2/c1-14-2-3-16-13-17(5-4-15(16)12-14)18(21)19-6-7-20-8-10-22-11-9-20/h2-5,12-13H,6-11H2,1H3,(H,19,21)
InChIKeyXZFSJVDJFJIEBH-UHFFFAOYSA-N
XLogP2.21
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide?
The IUPAC name of 6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide (CID 142825868) is 6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide.
What is the SMILES notation for 6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide?
The canonical SMILES for 6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide is Cc1ccc2cc(C(=O)NCCN3CCOCC3)ccc2c1.
What is the InChIKey of 6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide?
The InChIKey is XZFSJVDJFJIEBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-14-2-3-16-13-17(5-4-15(16)12-14)18(21)19-6-7-20-8-10-22-11-9-20/h2-5,12-13H,6-11H2,1H3,(H,19,21).
What are the key properties of 6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide?
6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide has a molecular weight of 298.39 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide is sourced from PubChem (CID 142825868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).