4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine

C12H19NO2 — CID 134968283

IUPAC4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine
SMILESCC(C)[C@@H](c1ccco1)N1CCOCC1
InChIInChI=1S/C12H19NO2/c1-10(2)12(11-4-3-7-15-11)13-5-8-14-9-6-13/h3-4,7,10,12H,5-6,8-9H2,1-2H3/t12-/m0/s1
InChIKeyPZSLAHKVAKIOGP-LBPRGKRZSA-N
MW209.29 g/mol
LogP2.31
Rot. Bonds3

About 4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine

4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine (PubChem CID 134968283) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine.

Molecular Properties

Compound Name4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine
PubChem CID134968283
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine
SMILESCC(C)[C@@H](c1ccco1)N1CCOCC1
InChIInChI=1S/C12H19NO2/c1-10(2)12(11-4-3-7-15-11)13-5-8-14-9-6-13/h3-4,7,10,12H,5-6,8-9H2,1-2H3/t12-/m0/s1
InChIKeyPZSLAHKVAKIOGP-LBPRGKRZSA-N
XLogP2.31
TPSA25.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine?
The IUPAC name of 4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine (CID 134968283) is 4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine.
What is the SMILES notation for 4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine?
The canonical SMILES for 4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine is CC(C)[C@@H](c1ccco1)N1CCOCC1.
What is the InChIKey of 4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine?
The InChIKey is PZSLAHKVAKIOGP-LBPRGKRZSA-N. The full InChI is InChI=1S/C12H19NO2/c1-10(2)12(11-4-3-7-15-11)13-5-8-14-9-6-13/h3-4,7,10,12H,5-6,8-9H2,1-2H3/t12-/m0/s1.
What are the key properties of 4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine?
4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine has a molecular weight of 209.29 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1S)-1-(furan-2-yl)-2-methylpropyl]morpholine is sourced from PubChem (CID 134968283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).