N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide

C18H14N2O2 — CID 137290368

IUPACN-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide
SMILESO=C(N/N=C/c1cccc2ccc(O)cc12)c1ccccc1
InChIInChI=1S/C18H14N2O2/c21-16-10-9-13-7-4-8-15(17(13)11-16)12-19-20-18(22)14-5-2-1-3-6-14/h1-12,21H,(H,20,22)/b19-12+
InChIKeyFMHCLDMXOPZSNF-XDHOZWIPSA-N
MW290.32 g/mol
LogP3.31
Rot. Bonds3

About N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide

N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide (PubChem CID 137290368) has the molecular formula C18H14N2O2 and a molecular weight of 290.32 g/mol. Its IUPAC name is N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide.

Molecular Properties

Compound NameN-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide
PubChem CID137290368
Molecular FormulaC18H14N2O2
Molecular Weight290.32 g/mol
Exact Mass290.11
IUPAC NameN-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide
SMILESO=C(N/N=C/c1cccc2ccc(O)cc12)c1ccccc1
InChIInChI=1S/C18H14N2O2/c21-16-10-9-13-7-4-8-15(17(13)11-16)12-19-20-18(22)14-5-2-1-3-6-14/h1-12,21H,(H,20,22)/b19-12+
InChIKeyFMHCLDMXOPZSNF-XDHOZWIPSA-N
XLogP3.31
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

4-hydroxy-N-[(Z)-naphthalen-1-ylmethylideneamino]benzamide
CID 5406601
N-[(Z)-naphthalen-1-ylmethylideneamino]benzamide
CID 5397614
2,5-dihydroxy-N-[(E)-naphthalen-1-ylmethylideneamino]benzamide
CID 17126515
N-[(E)-benzylideneamino]-3-hydroxybenzamide
CID 6869110
N-[(E)-naphthalen-1-ylmethylideneamino]-3-phenoxybenzamide
CID 71467467
N-[(E)-(2,3-dihydroxyphenyl)methylideneamino]-3-hydroxybenzamide
CID 135852734
3-hydroxy-N-[(E)-(2-phenylmethoxyphenyl)methylideneamino]benzamide
CID 6911496
3-amino-4-hydroxy-N-[(E)-naphthalen-1-ylmethylideneamino]benzamide
CID 59091698
N-[(Z)-anthracen-9-ylmethylideneamino]-3-hydroxybenzamide
CID 6016653
3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide
CID 135708473
4-hydroxy-N-[(E)-(4-hydroxynaphthalen-1-yl)methylideneamino]benzamide
CID 135542439
N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide
CID 135608250

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide?
The IUPAC name of N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide (CID 137290368) is N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide.
What is the SMILES notation for N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide?
The canonical SMILES for N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide is O=C(N/N=C/c1cccc2ccc(O)cc12)c1ccccc1.
What is the InChIKey of N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide?
The InChIKey is FMHCLDMXOPZSNF-XDHOZWIPSA-N. The full InChI is InChI=1S/C18H14N2O2/c21-16-10-9-13-7-4-8-15(17(13)11-16)12-19-20-18(22)14-5-2-1-3-6-14/h1-12,21H,(H,20,22)/b19-12+.
What are the key properties of N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide?
N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide has a molecular weight of 290.32 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide is sourced from PubChem (CID 137290368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).