N-cyclohexyl-4-methylaniline

C13H19N — CID 11424045

IUPACN-cyclohexyl-4-methylaniline
SMILESCc1ccc(NC2CCCCC2)cc1
InChIInChI=1S/C13H19N/c1-11-7-9-13(10-8-11)14-12-5-3-2-4-6-12/h7-10,12,14H,2-6H2,1H3
InChIKeyVIBIPXFOYXNBEO-UHFFFAOYSA-N
MW189.30 g/mol
LogP3.74
Rot. Bonds2

About N-cyclohexyl-4-methylaniline

N-cyclohexyl-4-methylaniline (PubChem CID 11424045) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is N-cyclohexyl-4-methylaniline.

Molecular Properties

Compound NameN-cyclohexyl-4-methylaniline
PubChem CID11424045
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC NameN-cyclohexyl-4-methylaniline
SMILESCc1ccc(NC2CCCCC2)cc1
InChIInChI=1S/C13H19N/c1-11-7-9-13(10-8-11)14-12-5-3-2-4-6-12/h7-10,12,14H,2-6H2,1H3
InChIKeyVIBIPXFOYXNBEO-UHFFFAOYSA-N
XLogP3.74
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-methylaniline?
The IUPAC name of N-cyclohexyl-4-methylaniline (CID 11424045) is N-cyclohexyl-4-methylaniline.
What is the SMILES notation for N-cyclohexyl-4-methylaniline?
The canonical SMILES for N-cyclohexyl-4-methylaniline is Cc1ccc(NC2CCCCC2)cc1.
What is the InChIKey of N-cyclohexyl-4-methylaniline?
The InChIKey is VIBIPXFOYXNBEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-11-7-9-13(10-8-11)14-12-5-3-2-4-6-12/h7-10,12,14H,2-6H2,1H3.
What are the key properties of N-cyclohexyl-4-methylaniline?
N-cyclohexyl-4-methylaniline has a molecular weight of 189.30 g/mol, XLogP of 3.74, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-methylaniline is sourced from PubChem (CID 11424045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).