2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide

C9H14N2O3 — CID 60901417

IUPAC2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide
SMILESCNC(=O)CNCC(O)c1ccco1
InChIInChI=1S/C9H14N2O3/c1-10-9(13)6-11-5-7(12)8-3-2-4-14-8/h2-4,7,11-12H,5-6H2,1H3,(H,10,13)
InChIKeyDDFGCNGDUWKJQV-UHFFFAOYSA-N
MW198.22 g/mol
LogP-0.35
Rot. Bonds5

About 2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide

2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide (PubChem CID 60901417) has the molecular formula C9H14N2O3 and a molecular weight of 198.22 g/mol. Its IUPAC name is 2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide.

Molecular Properties

Compound Name2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide
PubChem CID60901417
Molecular FormulaC9H14N2O3
Molecular Weight198.22 g/mol
Exact Mass198.10
IUPAC Name2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide
SMILESCNC(=O)CNCC(O)c1ccco1
InChIInChI=1S/C9H14N2O3/c1-10-9(13)6-11-5-7(12)8-3-2-4-14-8/h2-4,7,11-12H,5-6H2,1H3,(H,10,13)
InChIKeyDDFGCNGDUWKJQV-UHFFFAOYSA-N
XLogP-0.35
TPSA74.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 5-0.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-1-pyrrolidin-1-ylethanone
CID 113406015
methyl 3-[[2-(furan-2-yl)-2-hydroxyethyl]amino]propanoate
CID 60925426
1-[2-(furan-2-yl)-2-hydroxyethyl]-3-methylthiourea
CID 131207302
1-(furan-2-yl)-2-(3-methylbut-2-enylamino)ethanol
CID 106546957
1-(furan-2-yl)-2-(2-methoxyethoxyamino)ethanol
CID 82721538
1-(furan-2-yl)-2-[(1-methylpyrrol-2-yl)methylamino]ethanol
CID 71982545
2-[[2-(3-bromophenyl)-2-hydroxyethyl]amino]-N-methylacetamide
CID 60901239
N-ethyl-N'-[2-(furan-2-yl)-2-hydroxyethyl]pentanediamide
CID 111102313
N-[2-(furan-2-yl)-2-hydroxyethyl]-2,2,4-trimethylpentanamide
CID 111971968
N-[2-(furan-2-yl)-2-hydroxyethyl]-4-methoxybutanamide
CID 110899101
1-cyclopropyl-2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]ethanol
CID 63296627
2-(ethylamino)-N-[(1R)-1-(furan-2-yl)ethyl]acetamide
CID 81400688

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide?
The IUPAC name of 2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide (CID 60901417) is 2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide.
What is the SMILES notation for 2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide?
The canonical SMILES for 2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide is CNC(=O)CNCC(O)c1ccco1.
What is the InChIKey of 2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide?
The InChIKey is DDFGCNGDUWKJQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3/c1-10-9(13)6-11-5-7(12)8-3-2-4-14-8/h2-4,7,11-12H,5-6H2,1H3,(H,10,13).
What are the key properties of 2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide?
2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide has a molecular weight of 198.22 g/mol, XLogP of -0.35, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-N-methylacetamide is sourced from PubChem (CID 60901417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).