2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol

C15H23NO2 — CID 62365432

IUPAC2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol
SMILESCC1CC1c1ccc(CNC2CCCCC2O)o1
InChIInChI=1S/C15H23NO2/c1-10-8-12(10)15-7-6-11(18-15)9-16-13-4-2-3-5-14(13)17/h6-7,10,12-14,16-17H,2-5,8-9H2,1H3
InChIKeyZZTOBKKQTSOJCO-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.80
Rot. Bonds4

About 2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol

2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol (PubChem CID 62365432) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol
PubChem CID62365432
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol
SMILESCC1CC1c1ccc(CNC2CCCCC2O)o1
InChIInChI=1S/C15H23NO2/c1-10-8-12(10)15-7-6-11(18-15)9-16-13-4-2-3-5-14(13)17/h6-7,10,12-14,16-17H,2-5,8-9H2,1H3
InChIKeyZZTOBKKQTSOJCO-UHFFFAOYSA-N
XLogP2.80
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol?
The IUPAC name of 2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol (CID 62365432) is 2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol.
What is the SMILES notation for 2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol?
The canonical SMILES for 2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol is CC1CC1c1ccc(CNC2CCCCC2O)o1.
What is the InChIKey of 2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol?
The InChIKey is ZZTOBKKQTSOJCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-10-8-12(10)15-7-6-11(18-15)9-16-13-4-2-3-5-14(13)17/h6-7,10,12-14,16-17H,2-5,8-9H2,1H3.
What are the key properties of 2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol?
2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol has a molecular weight of 249.35 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]cyclohexan-1-ol is sourced from PubChem (CID 62365432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).