N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide

C14H24N2O4S — CID 70716595

IUPACN-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide
SMILESCC[C@H]1COCCN1Cc1ccc(CN(C)S(C)(=O)=O)o1
InChIInChI=1S/C14H24N2O4S/c1-4-12-11-19-8-7-16(12)10-14-6-5-13(20-14)9-15(2)21(3,17)18/h5-6,12H,4,7-11H2,1-3H3/t12-/m0/s1
InChIKeyMCJPHYHRHJFFET-LBPRGKRZSA-N
MW316.42 g/mol
LogP1.28
Rot. Bonds6

About N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide

N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide (PubChem CID 70716595) has the molecular formula C14H24N2O4S and a molecular weight of 316.42 g/mol. Its IUPAC name is N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide
PubChem CID70716595
Molecular FormulaC14H24N2O4S
Molecular Weight316.42 g/mol
Exact Mass316.15
IUPAC NameN-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide
SMILESCC[C@H]1COCCN1Cc1ccc(CN(C)S(C)(=O)=O)o1
InChIInChI=1S/C14H24N2O4S/c1-4-12-11-19-8-7-16(12)10-14-6-5-13(20-14)9-15(2)21(3,17)18/h5-6,12H,4,7-11H2,1-3H3/t12-/m0/s1
InChIKeyMCJPHYHRHJFFET-LBPRGKRZSA-N
XLogP1.28
TPSA62.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.42
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[5-[(3-ethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine
CID 62432573
N-[[5-[(3-ethylmorpholin-4-yl)methyl]furan-2-yl]methyl]cyclopropanamine
CID 55074092
N-[[5-[[(3R)-3-ethyl-4-propan-2-ylpiperazin-1-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide
CID 95710542
N-[2-[1-[[5-[[methyl(methylsulfonyl)amino]methyl]furan-2-yl]methyl]piperidin-2-yl]ethyl]acetamide
CID 70752311
(3S)-4-benzyl-3-ethylmorpholine
CID 54501252
4-[(2-chloro-5-nitrophenyl)methyl]-3-ethylmorpholine
CID 43613129
5-[(3-ethylmorpholin-4-yl)methyl]-1-benzofuran-2-carboxylic acid
CID 65295011
2-[(3-ethylmorpholin-4-yl)methyl]furan-3-carboxylic acid
CID 43613412
3-[(3-ethylmorpholin-4-yl)methyl]aniline
CID 43611627
4-[(3,6-dichloro-2-pyridinyl)methyl]-3-ethylmorpholine
CID 62890747
3-[4-[(3-ethylmorpholin-4-yl)methyl]phenyl]prop-2-enoic acid
CID 76909426
2-[(3-ethylmorpholin-4-yl)methyl]-4-fluorobenzoic acid
CID 114014611

Frequently Asked Questions

What is the IUPAC name of N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide?
The IUPAC name of N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide (CID 70716595) is N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide.
What is the SMILES notation for N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide?
The canonical SMILES for N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide is CC[C@H]1COCCN1Cc1ccc(CN(C)S(C)(=O)=O)o1.
What is the InChIKey of N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide?
The InChIKey is MCJPHYHRHJFFET-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H24N2O4S/c1-4-12-11-19-8-7-16(12)10-14-6-5-13(20-14)9-15(2)21(3,17)18/h5-6,12H,4,7-11H2,1-3H3/t12-/m0/s1.
What are the key properties of N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide?
N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide has a molecular weight of 316.42 g/mol, XLogP of 1.28, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[[(3S)-3-ethylmorpholin-4-yl]methyl]furan-2-yl]methyl]-N-methylmethanesulfonamide is sourced from PubChem (CID 70716595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).