N-cyclohexyl-4-methyl-N-phenylaniline

C19H23N — CID 58662978

IUPACN-cyclohexyl-4-methyl-N-phenylaniline
SMILESCc1ccc(N(c2ccccc2)C2CCCCC2)cc1
InChIInChI=1S/C19H23N/c1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2,4-5,8-9,12-15,18H,3,6-7,10-11H2,1H3
InChIKeyWDFOOBXQNDPDCB-UHFFFAOYSA-N
MW265.40 g/mol
LogP5.47
Rot. Bonds3

About N-cyclohexyl-4-methyl-N-phenylaniline

N-cyclohexyl-4-methyl-N-phenylaniline (PubChem CID 58662978) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is N-cyclohexyl-4-methyl-N-phenylaniline.

Molecular Properties

Compound NameN-cyclohexyl-4-methyl-N-phenylaniline
PubChem CID58662978
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC NameN-cyclohexyl-4-methyl-N-phenylaniline
SMILESCc1ccc(N(c2ccccc2)C2CCCCC2)cc1
InChIInChI=1S/C19H23N/c1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2,4-5,8-9,12-15,18H,3,6-7,10-11H2,1H3
InChIKeyWDFOOBXQNDPDCB-UHFFFAOYSA-N
XLogP5.47
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.40
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-methyl-N-phenylaniline?
The IUPAC name of N-cyclohexyl-4-methyl-N-phenylaniline (CID 58662978) is N-cyclohexyl-4-methyl-N-phenylaniline.
What is the SMILES notation for N-cyclohexyl-4-methyl-N-phenylaniline?
The canonical SMILES for N-cyclohexyl-4-methyl-N-phenylaniline is Cc1ccc(N(c2ccccc2)C2CCCCC2)cc1.
What is the InChIKey of N-cyclohexyl-4-methyl-N-phenylaniline?
The InChIKey is WDFOOBXQNDPDCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2,4-5,8-9,12-15,18H,3,6-7,10-11H2,1H3.
What are the key properties of N-cyclohexyl-4-methyl-N-phenylaniline?
N-cyclohexyl-4-methyl-N-phenylaniline has a molecular weight of 265.40 g/mol, XLogP of 5.47, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-methyl-N-phenylaniline is sourced from PubChem (CID 58662978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).