cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine

C18H24N2 — CID 142003483

IUPACcyclohexanamine;(4-methylnaphthalen-1-yl)methanimine
SMILESNC1CCCCC1.[H]/N=C/c1ccc(C)c2ccccc12
InChIInChI=1S/C12H11N.C6H13N/c1-9-6-7-10(8-13)12-5-3-2-4-11(9)12;7-6-4-2-1-3-5-6/h2-8,13H,1H3;6H,1-5,7H2/b13-8+;
InChIKeyCBSFDUHYBYNVRN-FNXZNAJJSA-N
MW268.40 g/mol
LogP4.42
Rot. Bonds1

About cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine

cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine (PubChem CID 142003483) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine.

Molecular Properties

Compound Namecyclohexanamine;(4-methylnaphthalen-1-yl)methanimine
PubChem CID142003483
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Namecyclohexanamine;(4-methylnaphthalen-1-yl)methanimine
SMILESNC1CCCCC1.[H]/N=C/c1ccc(C)c2ccccc12
InChIInChI=1S/C12H11N.C6H13N/c1-9-6-7-10(8-13)12-5-3-2-4-11(9)12;7-6-4-2-1-3-5-6/h2-8,13H,1H3;6H,1-5,7H2/b13-8+;
InChIKeyCBSFDUHYBYNVRN-FNXZNAJJSA-N
XLogP4.42
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-methanimidoylnaphthalen-1-yl)sulfanylcyclopentanamine
CID 142003423
1-cyclopentyloxy-4-methylnaphthalene
CID 143504942
1-(2-cyclohexylethoxy)-4-methylnaphthalene
CID 123891413
1-methyl-4-(2-phenylethenyl)naphthalene
CID 4283155
(1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride
CID 171208948
cyclohexanamine;diphenylmethanediamine
CID 175293358
cyclohexane;iron(3+);bis(2-methanimidoylphenolate);chloride
CID 45110648
3-cyclohexyl-1-(2-methylnaphthalen-1-yl)propan-1-amine
CID 81430295
(7-methyl-1H-indol-3-yl)methanimine
CID 143450197
[(E)-3-(4-methylnaphthalen-1-yl)prop-2-enyl] 2,2,2-trichloroethanimidate
CID 54756728
cyclohexanamine;3-methyl-2-phenylquinoline-4-carboxylic acid
CID 19715596
cycloheptanamine;phenylmethanamine
CID 162192852

Frequently Asked Questions

What is the IUPAC name of cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine?
The IUPAC name of cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine (CID 142003483) is cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine.
What is the SMILES notation for cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine?
The canonical SMILES for cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine is NC1CCCCC1.[H]/N=C/c1ccc(C)c2ccccc12.
What is the InChIKey of cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine?
The InChIKey is CBSFDUHYBYNVRN-FNXZNAJJSA-N. The full InChI is InChI=1S/C12H11N.C6H13N/c1-9-6-7-10(8-13)12-5-3-2-4-11(9)12;7-6-4-2-1-3-5-6/h2-8,13H,1H3;6H,1-5,7H2/b13-8+;.
What are the key properties of cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine?
cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine has a molecular weight of 268.40 g/mol, XLogP of 4.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexanamine;(4-methylnaphthalen-1-yl)methanimine is sourced from PubChem (CID 142003483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).