N-cyclohexyl-4-iodopyridin-2-amine

C11H15IN2 — CID 46899555

IUPACN-cyclohexyl-4-iodopyridin-2-amine
SMILESIc1ccnc(NC2CCCCC2)c1
InChIInChI=1S/C11H15IN2/c12-9-6-7-13-11(8-9)14-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,13,14)
InChIKeyBRQGPVNKXJJVMY-UHFFFAOYSA-N
MW302.16 g/mol
LogP3.43
Rot. Bonds2

About N-cyclohexyl-4-iodopyridin-2-amine

N-cyclohexyl-4-iodopyridin-2-amine (PubChem CID 46899555) has the molecular formula C11H15IN2 and a molecular weight of 302.16 g/mol. Its IUPAC name is N-cyclohexyl-4-iodopyridin-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-4-iodopyridin-2-amine
PubChem CID46899555
Molecular FormulaC11H15IN2
Molecular Weight302.16 g/mol
Exact Mass302.03
IUPAC NameN-cyclohexyl-4-iodopyridin-2-amine
SMILESIc1ccnc(NC2CCCCC2)c1
InChIInChI=1S/C11H15IN2/c12-9-6-7-13-11(8-9)14-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,13,14)
InChIKeyBRQGPVNKXJJVMY-UHFFFAOYSA-N
XLogP3.43
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.16
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-iodopyridin-2-amine?
The IUPAC name of N-cyclohexyl-4-iodopyridin-2-amine (CID 46899555) is N-cyclohexyl-4-iodopyridin-2-amine.
What is the SMILES notation for N-cyclohexyl-4-iodopyridin-2-amine?
The canonical SMILES for N-cyclohexyl-4-iodopyridin-2-amine is Ic1ccnc(NC2CCCCC2)c1.
What is the InChIKey of N-cyclohexyl-4-iodopyridin-2-amine?
The InChIKey is BRQGPVNKXJJVMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15IN2/c12-9-6-7-13-11(8-9)14-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,13,14).
What are the key properties of N-cyclohexyl-4-iodopyridin-2-amine?
N-cyclohexyl-4-iodopyridin-2-amine has a molecular weight of 302.16 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-iodopyridin-2-amine is sourced from PubChem (CID 46899555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).