N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide

C12H10N2O2 — CID 135676247

IUPACN-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide
SMILESO=CN/N=C/c1c(O)ccc2ccccc12
InChIInChI=1S/C12H10N2O2/c15-8-14-13-7-11-10-4-2-1-3-9(10)5-6-12(11)16/h1-8,16H,(H,14,15)/b13-7+
InChIKeyARGMWTRVKNOTRD-NTUHNPAUSA-N
MW214.22 g/mol
LogP1.63
Rot. Bonds3

About N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide

N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide (PubChem CID 135676247) has the molecular formula C12H10N2O2 and a molecular weight of 214.22 g/mol. Its IUPAC name is N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide.

Molecular Properties

Compound NameN-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide
PubChem CID135676247
Molecular FormulaC12H10N2O2
Molecular Weight214.22 g/mol
Exact Mass214.07
IUPAC NameN-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide
SMILESO=CN/N=C/c1c(O)ccc2ccccc12
InChIInChI=1S/C12H10N2O2/c15-8-14-13-7-11-10-4-2-1-3-9(10)5-6-12(11)16/h1-8,16H,(H,14,15)/b13-7+
InChIKeyARGMWTRVKNOTRD-NTUHNPAUSA-N
XLogP1.63
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-Hydroxy-1-naphthaldehyde thiosemicarbazone
CID 135400403
1-Naphthalenecarboxaldehyde, 2-hydroxy-, [(2-hydroxy-1-naphthalenyl)methylene]hydrazone
CID 135444602
2-Hydroxy-1-naphthaldehyde N-ethylthiosemicarbazone
CID 135493221
2-Hydroxy-1-naphthaldehyde oxime
CID 135400485
N'-[(2-hydroxy-1-naphthyl)methylene]-1-methyl-6-oxo-1,6-dihydro-3-pyridinecarbohydrazide
CID 135458990
(E)-2-((2-Hydroxynaphthalen-1-yl)methylene)-N,N-dimethylhydrazine-1-carbothioamide
CID 135482104
(E)-N-Hydroxy-7-(2-((2-hydroxynaphthalen-1-yl)methylene)hydrazinyl)-7-oxoheptanamide
CID 135922679
N-[(2-hydroxynaphthalen-1-yl)methylideneamino]cyclopropanecarboxamide
CID 251900
1-[(4-Methylthiosemicarbazono)methyl]-2-naphthol
CID 135506505
1-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]-3-prop-2-enylthiourea
CID 135615739
2-Hydroxy-1-naphthaldehyde dimethylhydrazone
CID 135490277
(E)-methyl 2-((2-hydroxynaphthalen-1-yl)methylene)hydrazinecarbimidothioate
CID 135412250

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide?
The IUPAC name of N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide (CID 135676247) is N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide.
What is the SMILES notation for N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide?
The canonical SMILES for N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide is O=CN/N=C/c1c(O)ccc2ccccc12.
What is the InChIKey of N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide?
The InChIKey is ARGMWTRVKNOTRD-NTUHNPAUSA-N. The full InChI is InChI=1S/C12H10N2O2/c15-8-14-13-7-11-10-4-2-1-3-9(10)5-6-12(11)16/h1-8,16H,(H,14,15)/b13-7+.
What are the key properties of N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide?
N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide has a molecular weight of 214.22 g/mol, XLogP of 1.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]formamide is sourced from PubChem (CID 135676247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).