2H-1,2-benzoxazine;cyclohexanamine

C14H20N2O — CID 175182018

IUPAC2H-1,2-benzoxazine;cyclohexanamine
SMILESC1=Cc2ccccc2ON1.NC1CCCCC1
InChIInChI=1S/C8H7NO.C6H13N/c1-2-4-8-7(3-1)5-6-9-10-8;7-6-4-2-1-3-5-6/h1-6,9H;6H,1-5,7H2
InChIKeyCGTBPZHPTGNUJG-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.83
Rot. Bonds

About 2H-1,2-benzoxazine;cyclohexanamine

2H-1,2-benzoxazine;cyclohexanamine (PubChem CID 175182018) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2H-1,2-benzoxazine;cyclohexanamine.

Molecular Properties

Compound Name2H-1,2-benzoxazine;cyclohexanamine
PubChem CID175182018
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2H-1,2-benzoxazine;cyclohexanamine
SMILESC1=Cc2ccccc2ON1.NC1CCCCC1
InChIInChI=1S/C8H7NO.C6H13N/c1-2-4-8-7(3-1)5-6-9-10-8;7-6-4-2-1-3-5-6/h1-6,9H;6H,1-5,7H2
InChIKeyCGTBPZHPTGNUJG-UHFFFAOYSA-N
XLogP2.83
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2H-1,2-benzoxazine;cyclohexanamine?
The IUPAC name of 2H-1,2-benzoxazine;cyclohexanamine (CID 175182018) is 2H-1,2-benzoxazine;cyclohexanamine.
What is the SMILES notation for 2H-1,2-benzoxazine;cyclohexanamine?
The canonical SMILES for 2H-1,2-benzoxazine;cyclohexanamine is C1=Cc2ccccc2ON1.NC1CCCCC1.
What is the InChIKey of 2H-1,2-benzoxazine;cyclohexanamine?
The InChIKey is CGTBPZHPTGNUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NO.C6H13N/c1-2-4-8-7(3-1)5-6-9-10-8;7-6-4-2-1-3-5-6/h1-6,9H;6H,1-5,7H2.
What are the key properties of 2H-1,2-benzoxazine;cyclohexanamine?
2H-1,2-benzoxazine;cyclohexanamine has a molecular weight of 232.33 g/mol, XLogP of 2.83, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-1,2-benzoxazine;cyclohexanamine is sourced from PubChem (CID 175182018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).