N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine

C15H23N3 — CID 168529451

IUPACN-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine
SMILESCN(Cc1ccccc1C=NN)C1CCCCC1
InChIInChI=1S/C15H23N3/c1-18(15-9-3-2-4-10-15)12-14-8-6-5-7-13(14)11-17-16/h5-8,11,15H,2-4,9-10,12,16H2,1H3
InChIKeyLPLHPCPLSYMQQX-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.74
Rot. Bonds4

About N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine

N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine (PubChem CID 168529451) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine.

Molecular Properties

Compound NameN-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine
PubChem CID168529451
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC NameN-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine
SMILESCN(Cc1ccccc1C=NN)C1CCCCC1
InChIInChI=1S/C15H23N3/c1-18(15-9-3-2-4-10-15)12-14-8-6-5-7-13(14)11-17-16/h5-8,11,15H,2-4,9-10,12,16H2,1H3
InChIKeyLPLHPCPLSYMQQX-UHFFFAOYSA-N
XLogP2.74
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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

1-(2-methanehydrazonoylphenyl)-N,N-dimethylmethanamine
CID 168530555
2-[[cyclopentyl(methyl)amino]methyl]aniline
CID 43266778
ethyl 2-[2-[2-[[2-[[cyclohexyl(methyl)amino]methyl]phenyl]methylidene]hydrazinyl]-1,3-thiazol-4-yl]acetate
CID 168623232
2-[[cyclohexyl(methyl)amino]methyl]benzenecarbothioamide
CID 24707191
[2-[[cyclohexyl(methyl)amino]methyl]phenyl] selenohypobromite
CID 102064196
N-[(2-chloro-3-pyridinyl)methyl]-N-methylcycloheptanamine
CID 62470734
2-[[2-[[cyclohexyl(methyl)amino]methyl]phenyl]methyl]-1-propan-2-ylguanidine
CID 111077965
1-tert-butyl-2-[[2-[[cyclohexyl(methyl)amino]methyl]phenyl]methyl]guanidine
CID 111077961
N-methyl-N-[[2-(propylaminomethyl)phenyl]methyl]cyclohexanamine
CID 62422996
2-[[2-[[cyclohexyl(methyl)amino]methyl]phenyl]iminomethyl]-5-methoxyphenol
CID 177466291
N'-[[2-[[cyclohexyl(methyl)amino]methyl]phenyl]methyl]morpholine-4-carboximidamide;hydroiodide
CID 111077954
2-[[cyclohexyl(methyl)amino]methyl]-6-fluorophenol
CID 112616052

Frequently Asked Questions

What is the IUPAC name of N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine?
The IUPAC name of N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine (CID 168529451) is N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine.
What is the SMILES notation for N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine?
The canonical SMILES for N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine is CN(Cc1ccccc1C=NN)C1CCCCC1.
What is the InChIKey of N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine?
The InChIKey is LPLHPCPLSYMQQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-18(15-9-3-2-4-10-15)12-14-8-6-5-7-13(14)11-17-16/h5-8,11,15H,2-4,9-10,12,16H2,1H3.
What are the key properties of N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine?
N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine has a molecular weight of 245.37 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methanehydrazonoylphenyl)methyl]-N-methylcyclohexanamine is sourced from PubChem (CID 168529451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).