N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide

C11H18N2O2 — CID 61249906

IUPACN-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide
SMILESCNCC(=O)NC(C)CCc1ccco1
InChIInChI=1S/C11H18N2O2/c1-9(13-11(14)8-12-2)5-6-10-4-3-7-15-10/h3-4,7,9,12H,5-6,8H2,1-2H3,(H,13,14)
InChIKeyBPPNOGUWBMSOEU-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.94
Rot. Bonds6

About N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide

N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide (PubChem CID 61249906) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide
PubChem CID61249906
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide
SMILESCNCC(=O)NC(C)CCc1ccco1
InChIInChI=1S/C11H18N2O2/c1-9(13-11(14)8-12-2)5-6-10-4-3-7-15-10/h3-4,7,9,12H,5-6,8H2,1-2H3,(H,13,14)
InChIKeyBPPNOGUWBMSOEU-UHFFFAOYSA-N
XLogP0.94
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(furan-2-yl)butan-2-yl]-3-oxobutanamide
CID 61251024
N-[(2R)-4-(furan-2-yl)butan-2-yl]-3-methylbutanamide
CID 94153264
5-amino-N-[4-(furan-2-yl)butan-2-yl]-4-methylpentanamide
CID 82012267
N-[4-(furan-2-yl)butan-2-yl]-4-(propan-2-ylamino)butanamide
CID 61249924
1-ethyl-3-[4-(furan-2-yl)butan-2-yl]urea
CID 115571916
N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide
CID 43401748
N-[2-[4-(furan-2-yl)butan-2-ylamino]-2-oxoethyl]thiophene-2-carboxamide
CID 18162547
ethyl N-[4-(furan-2-yl)butan-2-yl]carbamate
CID 60651451
1-tert-butyl-3-[4-(furan-2-yl)butan-2-yl]urea
CID 115571913
2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide
CID 18162432
tert-butyl 4-[4-(furan-2-yl)butan-2-ylamino]-4-oxobutanoate
CID 106707217
N-[2-[4-(furan-2-yl)butan-2-ylamino]-2-oxoethyl]-5-methylthiophene-2-carboxamide
CID 18162543

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide?
The IUPAC name of N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide (CID 61249906) is N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide.
What is the SMILES notation for N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide?
The canonical SMILES for N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide is CNCC(=O)NC(C)CCc1ccco1.
What is the InChIKey of N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide?
The InChIKey is BPPNOGUWBMSOEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-9(13-11(14)8-12-2)5-6-10-4-3-7-15-10/h3-4,7,9,12H,5-6,8H2,1-2H3,(H,13,14).
What are the key properties of N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide?
N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide has a molecular weight of 210.28 g/mol, XLogP of 0.94, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide is sourced from PubChem (CID 61249906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).