(3S)-4-(furan-3-yl)-3-methylmorpholine

C9H13NO2 — CID 141415715

IUPAC(3S)-4-(furan-3-yl)-3-methylmorpholine
SMILESC[C@H]1COCCN1c1ccoc1
InChIInChI=1S/C9H13NO2/c1-8-6-12-5-3-10(8)9-2-4-11-7-9/h2,4,7-8H,3,5-6H2,1H3/t8-/m0/s1
InChIKeyBRZZWCWLPZWOML-QMMMGPOBSA-N
MW167.21 g/mol
LogP1.50
Rot. Bonds1

About (3S)-4-(furan-3-yl)-3-methylmorpholine

(3S)-4-(furan-3-yl)-3-methylmorpholine (PubChem CID 141415715) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is (3S)-4-(furan-3-yl)-3-methylmorpholine.

Molecular Properties

Compound Name(3S)-4-(furan-3-yl)-3-methylmorpholine
PubChem CID141415715
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name(3S)-4-(furan-3-yl)-3-methylmorpholine
SMILESC[C@H]1COCCN1c1ccoc1
InChIInChI=1S/C9H13NO2/c1-8-6-12-5-3-10(8)9-2-4-11-7-9/h2,4,7-8H,3,5-6H2,1H3/t8-/m0/s1
InChIKeyBRZZWCWLPZWOML-QMMMGPOBSA-N
XLogP1.50
TPSA25.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-Acetamidofuran
CID 521882
Ammonium, (3-furyl)trimethyl-, iodide
CID 199990
4-(Furan-3-yl)morpholine
CID 12009355
3-Furylalanine
CID 22875442
3-Furylaminobutyric acid
CID 68798095
Furan-3-yl(trimethyl)azanium
CID 199991
N-(2-fluoroethyl)furan-3-amine
CID 140143628
N-(2,2-difluoroethyl)furan-3-amine
CID 151412690
4,4-Difluoro-1-(furan-3-yl)piperidine
CID 175988490
N-(furan-3-yl)pent-4-enamide
CID 11105709
ethyl N-(2-bromoprop-2-enyl)-N-(furan-3-yl)carbamate
CID 135076654
N,N-diethylfuran-3-amine
CID 12009356

Frequently Asked Questions

What is the IUPAC name of (3S)-4-(furan-3-yl)-3-methylmorpholine?
The IUPAC name of (3S)-4-(furan-3-yl)-3-methylmorpholine (CID 141415715) is (3S)-4-(furan-3-yl)-3-methylmorpholine.
What is the SMILES notation for (3S)-4-(furan-3-yl)-3-methylmorpholine?
The canonical SMILES for (3S)-4-(furan-3-yl)-3-methylmorpholine is C[C@H]1COCCN1c1ccoc1.
What is the InChIKey of (3S)-4-(furan-3-yl)-3-methylmorpholine?
The InChIKey is BRZZWCWLPZWOML-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H13NO2/c1-8-6-12-5-3-10(8)9-2-4-11-7-9/h2,4,7-8H,3,5-6H2,1H3/t8-/m0/s1.
What are the key properties of (3S)-4-(furan-3-yl)-3-methylmorpholine?
(3S)-4-(furan-3-yl)-3-methylmorpholine has a molecular weight of 167.21 g/mol, XLogP of 1.50, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-4-(furan-3-yl)-3-methylmorpholine is sourced from PubChem (CID 141415715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).