3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide

C30H24N2O3 — CID 3522022

IUPAC3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)NN=Cc1ccccc1OCc1cccc2ccccc12
InChIInChI=1S/C30H24N2O3/c1-34-29-18-23-11-3-2-10-22(23)17-27(29)30(33)32-31-19-24-12-5-7-16-28(24)35-20-25-14-8-13-21-9-4-6-15-26(21)25/h2-19H,20H2,1H3,(H,32,33)
InChIKeyNNKSTCKCVHCUDY-UHFFFAOYSA-N
MW460.53 g/mol
LogP6.34
Rot. Bonds7

About 3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide

3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide (PubChem CID 3522022) has the molecular formula C30H24N2O3 and a molecular weight of 460.53 g/mol. Its IUPAC name is 3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide
PubChem CID3522022
Molecular FormulaC30H24N2O3
Molecular Weight460.53 g/mol
Exact Mass460.18
IUPAC Name3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)NN=Cc1ccccc1OCc1cccc2ccccc12
InChIInChI=1S/C30H24N2O3/c1-34-29-18-23-11-3-2-10-22(23)17-27(29)30(33)32-31-19-24-12-5-7-16-28(24)35-20-25-14-8-13-21-9-4-6-15-26(21)25/h2-19H,20H2,1H3,(H,32,33)
InChIKeyNNKSTCKCVHCUDY-UHFFFAOYSA-N
XLogP6.34
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500460.53
LogP ≤ 56.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-methoxy-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]naphthalene-2-carboxamide
CID 6070681
N-[(Z)-[3-bromo-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-3-methoxynaphthalene-2-carboxamide
CID 126376683
3-methyl-N-[(E)-[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]benzamide
CID 96892720
4-tert-butyl-N-[(Z)-[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]benzamide
CID 94831763
3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide
CID 6044173
N-[(2-iodophenyl)methylideneamino]-3-methoxynaphthalene-2-carboxamide
CID 2306154
N-[(2,4-dimethoxyphenyl)methylideneamino]-3-methoxynaphthalene-2-carboxamide
CID 3422870
N-[[2-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-3-hydroxynaphthalene-2-carboxamide
CID 5016843
N-[(Z)-[2-[(2-cyanophenyl)methoxy]naphthalen-1-yl]methylideneamino]-3-methoxynaphthalene-2-carboxamide
CID 6138625
N-[(Z)-[3-bromo-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-2,4-dimethoxybenzamide
CID 126388440
N-[(E)-(4-ethoxy-2-hydroxyphenyl)methylideneamino]-3-methoxynaphthalene-2-carboxamide
CID 135533021
2,4-dimethoxy-N-[(2-phenylmethoxyphenyl)methylideneamino]benzamide
CID 4562741

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide?
The IUPAC name of 3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide (CID 3522022) is 3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide.
What is the SMILES notation for 3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide?
The canonical SMILES for 3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide is COc1cc2ccccc2cc1C(=O)NN=Cc1ccccc1OCc1cccc2ccccc12.
What is the InChIKey of 3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide?
The InChIKey is NNKSTCKCVHCUDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H24N2O3/c1-34-29-18-23-11-3-2-10-22(23)17-27(29)30(33)32-31-19-24-12-5-7-16-28(24)35-20-25-14-8-13-21-9-4-6-15-26(21)25/h2-19H,20H2,1H3,(H,32,33).
What are the key properties of 3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide?
3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide has a molecular weight of 460.53 g/mol, XLogP of 6.34, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]naphthalene-2-carboxamide is sourced from PubChem (CID 3522022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).