N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide

C18H21NO3 — CID 30307912

IUPACN-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide
SMILESCOc1ccc2cc(CNC(=O)C3CCOCC3)ccc2c1
InChIInChI=1S/C18H21NO3/c1-21-17-5-4-15-10-13(2-3-16(15)11-17)12-19-18(20)14-6-8-22-9-7-14/h2-5,10-11,14H,6-9,12H2,1H3,(H,19,20)
InChIKeyZXNTXTYLYWHEAT-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.89
Rot. Bonds4

About N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide

N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide (PubChem CID 30307912) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide.

Molecular Properties

Compound NameN-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide
PubChem CID30307912
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC NameN-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide
SMILESCOc1ccc2cc(CNC(=O)C3CCOCC3)ccc2c1
InChIInChI=1S/C18H21NO3/c1-21-17-5-4-15-10-13(2-3-16(15)11-17)12-19-18(20)14-6-8-22-9-7-14/h2-5,10-11,14H,6-9,12H2,1H3,(H,19,20)
InChIKeyZXNTXTYLYWHEAT-UHFFFAOYSA-N
XLogP2.89
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(cyclopropanecarbonyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperidine-4-carboxamide
CID 46692059
N-[(3-methylphenyl)methyl]oxane-4-carboxamide
CID 30797255
3-N-[(6-methoxynaphthalen-2-yl)methyl]piperidine-1,3-dicarboxamide
CID 43041664
(3R)-3-N-[(6-methoxynaphthalen-2-yl)methyl]piperidine-1,3-dicarboxamide
CID 30307956
N-[(4-methoxyphenyl)methyl]oxane-3-carboxamide
CID 110851625
(6-methoxynaphthalen-2-yl)methylcarbamic acid
CID 115170918
N-[(4-methoxyphenyl)methyl]-1-(2-oxooxolan-3-yl)piperidine-4-carboxamide
CID 171913395
1-(4-cyanophenyl)sulfonyl-N-[(6-methoxynaphthalen-2-yl)methyl]piperidine-4-carboxamide
CID 41287615
1-(1,3-dioxolan-2-ylmethyl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 171907624
N-[(6-methoxynaphthalen-2-yl)methyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 51317174
N-[2-[(4-methoxyphenyl)methyl-methylsulfonylamino]ethyl]oxane-4-carboxamide
CID 113067193
N-[(4-methoxyphenyl)methyl]-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109145605

Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide?
The IUPAC name of N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide (CID 30307912) is N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide.
What is the SMILES notation for N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide?
The canonical SMILES for N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide is COc1ccc2cc(CNC(=O)C3CCOCC3)ccc2c1.
What is the InChIKey of N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide?
The InChIKey is ZXNTXTYLYWHEAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-21-17-5-4-15-10-13(2-3-16(15)11-17)12-19-18(20)14-6-8-22-9-7-14/h2-5,10-11,14H,6-9,12H2,1H3,(H,19,20).
What are the key properties of N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide?
N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide has a molecular weight of 299.37 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxynaphthalen-2-yl)methyl]oxane-4-carboxamide is sourced from PubChem (CID 30307912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).