N-[(E)-naphthalen-1-ylmethylideneamino]methanamine

C12H12N2 — CID 110337745

IUPACN-[(E)-naphthalen-1-ylmethylideneamino]methanamine
SMILESCN/N=C/c1cccc2ccccc12
InChIInChI=1S/C12H12N2/c1-13-14-9-11-7-4-6-10-5-2-3-8-12(10)11/h2-9,13H,1H3/b14-9+
InChIKeyGOVFZFZSFZYDRX-NTEUORMPSA-N
MW184.24 g/mol
LogP2.39
Rot. Bonds2

About N-[(E)-naphthalen-1-ylmethylideneamino]methanamine

N-[(E)-naphthalen-1-ylmethylideneamino]methanamine (PubChem CID 110337745) has the molecular formula C12H12N2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N-[(E)-naphthalen-1-ylmethylideneamino]methanamine.

Molecular Properties

Compound NameN-[(E)-naphthalen-1-ylmethylideneamino]methanamine
PubChem CID110337745
Molecular FormulaC12H12N2
Molecular Weight184.24 g/mol
Exact Mass184.10
IUPAC NameN-[(E)-naphthalen-1-ylmethylideneamino]methanamine
SMILESCN/N=C/c1cccc2ccccc12
InChIInChI=1S/C12H12N2/c1-13-14-9-11-7-4-6-10-5-2-3-8-12(10)11/h2-9,13H,1H3/b14-9+
InChIKeyGOVFZFZSFZYDRX-NTEUORMPSA-N
XLogP2.39
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(E)-naphthalen-1-ylmethylideneamino]methanamine 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

2-methyl-N-[(E)-naphthalen-1-ylmethylideneamino]propan-2-amine
CID 22891976
1,3-bis(naphthalen-1-ylmethylideneamino)thiourea
CID 5196948
N-[(E)-naphthalen-1-ylmethylideneamino]-N'-[(Z)-naphthalen-1-ylmethylideneamino]butanediamide
CID 92959506
4-fluoro-N-(naphthalen-1-ylmethylideneamino)aniline
CID 78597503
1-naphthalen-1-yl-N-propan-2-ylmethanimine
CID 10352682
N-[(E)-naphthalen-1-ylmethylideneamino]benzenecarbothioamide
CID 177496026
N-[(Z)-naphthalen-1-ylmethylideneamino]benzamide
CID 5397614
ethyl N-[(Z)-naphthalen-1-ylmethylideneamino]carbamate
CID 5399199
2-bromo-N-(naphthalen-1-ylmethylideneamino)propanamide
CID 5046667
N-[(Z)-naphthalen-1-ylmethylideneamino]-2-phenylacetamide
CID 5407611
1-[(Z)-naphthalen-1-ylmethylideneamino]-3-phenylthiourea
CID 5417284
N-(naphthalen-1-ylmethylideneamino)-4-(trifluoromethyl)aniline
CID 110842073

Frequently Asked Questions

What is the IUPAC name of N-[(E)-naphthalen-1-ylmethylideneamino]methanamine?
The IUPAC name of N-[(E)-naphthalen-1-ylmethylideneamino]methanamine (CID 110337745) is N-[(E)-naphthalen-1-ylmethylideneamino]methanamine.
What is the SMILES notation for N-[(E)-naphthalen-1-ylmethylideneamino]methanamine?
The canonical SMILES for N-[(E)-naphthalen-1-ylmethylideneamino]methanamine is CN/N=C/c1cccc2ccccc12.
What is the InChIKey of N-[(E)-naphthalen-1-ylmethylideneamino]methanamine?
The InChIKey is GOVFZFZSFZYDRX-NTEUORMPSA-N. The full InChI is InChI=1S/C12H12N2/c1-13-14-9-11-7-4-6-10-5-2-3-8-12(10)11/h2-9,13H,1H3/b14-9+.
What are the key properties of N-[(E)-naphthalen-1-ylmethylideneamino]methanamine?
N-[(E)-naphthalen-1-ylmethylideneamino]methanamine has a molecular weight of 184.24 g/mol, XLogP of 2.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-naphthalen-1-ylmethylideneamino]methanamine is sourced from PubChem (CID 110337745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).