N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine

C14H23NO2 — CID 28681399

IUPACN-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine
SMILESc1coc(COCCCNC2CCCCC2)c1
InChIInChI=1S/C14H23NO2/c1-2-6-13(7-3-1)15-9-5-10-16-12-14-8-4-11-17-14/h4,8,11,13,15H,1-3,5-7,9-10,12H2
InChIKeyRTJSYEGFFVXYDU-UHFFFAOYSA-N
MW237.34 g/mol
LogP3.11
Rot. Bonds7

About N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine

N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine (PubChem CID 28681399) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine.

Molecular Properties

Compound NameN-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine
PubChem CID28681399
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC NameN-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine
SMILESc1coc(COCCCNC2CCCCC2)c1
InChIInChI=1S/C14H23NO2/c1-2-6-13(7-3-1)15-9-5-10-16-12-14-8-4-11-17-14/h4,8,11,13,15H,1-3,5-7,9-10,12H2
InChIKeyRTJSYEGFFVXYDU-UHFFFAOYSA-N
XLogP3.11
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine?
The IUPAC name of N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine (CID 28681399) is N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine.
What is the SMILES notation for N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine?
The canonical SMILES for N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine is c1coc(COCCCNC2CCCCC2)c1.
What is the InChIKey of N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine?
The InChIKey is RTJSYEGFFVXYDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-2-6-13(7-3-1)15-9-5-10-16-12-14-8-4-11-17-14/h4,8,11,13,15H,1-3,5-7,9-10,12H2.
What are the key properties of N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine?
N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine has a molecular weight of 237.34 g/mol, XLogP of 3.11, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-ylmethoxy)propyl]cyclohexanamine is sourced from PubChem (CID 28681399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).