N-cyclohexyl-N,4-dimethylbenzenecarboximidamide

C15H22N2 — CID 53471334

IUPACN-cyclohexyl-N,4-dimethylbenzenecarboximidamide
SMILES[H]/N=C(\c1ccc(C)cc1)N(C)C1CCCCC1
InChIInChI=1S/C15H22N2/c1-12-8-10-13(11-9-12)15(16)17(2)14-6-4-3-5-7-14/h8-11,14,16H,3-7H2,1-2H3/b16-15+
InChIKeyQSQDARYFMZAICC-FOCLMDBBSA-N
MW230.36 g/mol
LogP3.58
Rot. Bonds2

About N-cyclohexyl-N,4-dimethylbenzenecarboximidamide

N-cyclohexyl-N,4-dimethylbenzenecarboximidamide (PubChem CID 53471334) has the molecular formula C15H22N2 and a molecular weight of 230.36 g/mol. Its IUPAC name is N-cyclohexyl-N,4-dimethylbenzenecarboximidamide.

Molecular Properties

Compound NameN-cyclohexyl-N,4-dimethylbenzenecarboximidamide
PubChem CID53471334
Molecular FormulaC15H22N2
Molecular Weight230.36 g/mol
Exact Mass230.18
IUPAC NameN-cyclohexyl-N,4-dimethylbenzenecarboximidamide
SMILES[H]/N=C(\c1ccc(C)cc1)N(C)C1CCCCC1
InChIInChI=1S/C15H22N2/c1-12-8-10-13(11-9-12)15(16)17(2)14-6-4-3-5-7-14/h8-11,14,16H,3-7H2,1-2H3/b16-15+
InChIKeyQSQDARYFMZAICC-FOCLMDBBSA-N
XLogP3.58
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.36
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N,4-dimethylbenzenecarboximidamide?
The IUPAC name of N-cyclohexyl-N,4-dimethylbenzenecarboximidamide (CID 53471334) is N-cyclohexyl-N,4-dimethylbenzenecarboximidamide.
What is the SMILES notation for N-cyclohexyl-N,4-dimethylbenzenecarboximidamide?
The canonical SMILES for N-cyclohexyl-N,4-dimethylbenzenecarboximidamide is [H]/N=C(\c1ccc(C)cc1)N(C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N,4-dimethylbenzenecarboximidamide?
The InChIKey is QSQDARYFMZAICC-FOCLMDBBSA-N. The full InChI is InChI=1S/C15H22N2/c1-12-8-10-13(11-9-12)15(16)17(2)14-6-4-3-5-7-14/h8-11,14,16H,3-7H2,1-2H3/b16-15+.
What are the key properties of N-cyclohexyl-N,4-dimethylbenzenecarboximidamide?
N-cyclohexyl-N,4-dimethylbenzenecarboximidamide has a molecular weight of 230.36 g/mol, XLogP of 3.58, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N,4-dimethylbenzenecarboximidamide is sourced from PubChem (CID 53471334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).