3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide

C24H20N2O3 — CID 6044173

IUPAC3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)N/N=C\c1ccc(OC)c2ccccc12
InChIInChI=1S/C24H20N2O3/c1-28-22-12-11-18(19-9-5-6-10-20(19)22)15-25-26-24(27)21-13-16-7-3-4-8-17(16)14-23(21)29-2/h3-15H,1-2H3,(H,26,27)/b25-15-
InChIKeyCCMQXBGWGBQTIO-MYYYXRDXSA-N
MW384.44 g/mol
LogP4.77
Rot. Bonds5

About 3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide

3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide (PubChem CID 6044173) has the molecular formula C24H20N2O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is 3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide
PubChem CID6044173
Molecular FormulaC24H20N2O3
Molecular Weight384.44 g/mol
Exact Mass384.15
IUPAC Name3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)N/N=C\c1ccc(OC)c2ccccc12
InChIInChI=1S/C24H20N2O3/c1-28-22-12-11-18(19-9-5-6-10-20(19)22)15-25-26-24(27)21-13-16-7-3-4-8-17(16)14-23(21)29-2/h3-15H,1-2H3,(H,26,27)/b25-15-
InChIKeyCCMQXBGWGBQTIO-MYYYXRDXSA-N
XLogP4.77
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.77
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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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide?
The IUPAC name of 3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide (CID 6044173) is 3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide.
What is the SMILES notation for 3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide?
The canonical SMILES for 3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide is COc1cc2ccccc2cc1C(=O)N/N=C\c1ccc(OC)c2ccccc12.
What is the InChIKey of 3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide?
The InChIKey is CCMQXBGWGBQTIO-MYYYXRDXSA-N. The full InChI is InChI=1S/C24H20N2O3/c1-28-22-12-11-18(19-9-5-6-10-20(19)22)15-25-26-24(27)21-13-16-7-3-4-8-17(16)14-23(21)29-2/h3-15H,1-2H3,(H,26,27)/b25-15-.
What are the key properties of 3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide?
3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide has a molecular weight of 384.44 g/mol, XLogP of 4.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide is sourced from PubChem (CID 6044173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).