2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide

C14H20N4O3 — CID 129477090

IUPAC2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide
SMILESCN(CC(N)=O)C[C@H]1CN(Cc2ccc(C#N)o2)CCO1
InChIInChI=1S/C14H20N4O3/c1-17(10-14(16)19)7-13-9-18(4-5-20-13)8-12-3-2-11(6-15)21-12/h2-3,13H,4-5,7-10H2,1H3,(H2,16,19)/t13-/m0/s1
InChIKeyYLRPOHMBTDDIQY-ZDUSSCGKSA-N
MW292.34 g/mol
LogP-0.23
Rot. Bonds6

About 2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide

2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide (PubChem CID 129477090) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide.

Molecular Properties

Compound Name2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide
PubChem CID129477090
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide
SMILESCN(CC(N)=O)C[C@H]1CN(Cc2ccc(C#N)o2)CCO1
InChIInChI=1S/C14H20N4O3/c1-17(10-14(16)19)7-13-9-18(4-5-20-13)8-12-3-2-11(6-15)21-12/h2-3,13H,4-5,7-10H2,1H3,(H2,16,19)/t13-/m0/s1
InChIKeyYLRPOHMBTDDIQY-ZDUSSCGKSA-N
XLogP-0.23
TPSA95.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[[(2R)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide
CID 129477089
[5-[[(2S)-2-[[cyclopropylmethyl(methyl)amino]methyl]morpholin-4-yl]methyl]furan-2-yl]methanol
CID 129344343
2-[[(2S)-4-(4-cyano-2,2-dimethylbutyl)morpholin-2-yl]methyl-methylamino]acetamide
CID 129334529
2-[[4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide;hydrochloride
CID 120904709
2-[methyl-[[4-[(5-methyl-1H-pyrazol-4-yl)methyl]morpholin-2-yl]methyl]amino]acetamide
CID 128973253
2-[methyl-[[(2R)-4-[(5-propan-2-yl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]amino]acetamide
CID 129340998
2-[[4-[(4-bromo-3-methylphenyl)methyl]morpholin-2-yl]methyl-methylamino]acetic acid
CID 122043553
2-[[4-[(3-bromophenyl)methyl]morpholin-2-yl]methyl-methylamino]acetic acid
CID 122043743
2-[(4-ethylsulfonylmorpholin-2-yl)methyl-methylamino]acetamide
CID 154739726
(2R,3S)-2-[1-[(5-cyanofuran-2-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide
CID 154756732
2-[[4-[[4-(4-chlorophenyl)phenyl]methyl]morpholin-2-yl]methyl-methylamino]acetic acid
CID 122043659
2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide
CID 125141381

Frequently Asked Questions

What is the IUPAC name of 2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide?
The IUPAC name of 2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide (CID 129477090) is 2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide.
What is the SMILES notation for 2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide?
The canonical SMILES for 2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide is CN(CC(N)=O)C[C@H]1CN(Cc2ccc(C#N)o2)CCO1.
What is the InChIKey of 2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide?
The InChIKey is YLRPOHMBTDDIQY-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-17(10-14(16)19)7-13-9-18(4-5-20-13)8-12-3-2-11(6-15)21-12/h2-3,13H,4-5,7-10H2,1H3,(H2,16,19)/t13-/m0/s1.
What are the key properties of 2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide?
2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide has a molecular weight of 292.34 g/mol, XLogP of -0.23, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2S)-4-[(5-cyanofuran-2-yl)methyl]morpholin-2-yl]methyl-methylamino]acetamide is sourced from PubChem (CID 129477090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).