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

C12H20N2O2 — CID 43401748

IUPACN-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide
SMILESCCNC(=O)CNC(C)CCc1ccco1
InChIInChI=1S/C12H20N2O2/c1-3-13-12(15)9-14-10(2)6-7-11-5-4-8-16-11/h4-5,8,10,14H,3,6-7,9H2,1-2H3,(H,13,15)
InChIKeyPJHJNHIWXJEQHP-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.33
Rot. Bonds7

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

N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide (PubChem CID 43401748) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide
PubChem CID43401748
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC NameN-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide
SMILESCCNC(=O)CNC(C)CCc1ccco1
InChIInChI=1S/C12H20N2O2/c1-3-13-12(15)9-14-10(2)6-7-11-5-4-8-16-11/h4-5,8,10,14H,3,6-7,9H2,1-2H3,(H,13,15)
InChIKeyPJHJNHIWXJEQHP-UHFFFAOYSA-N
XLogP1.33
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-3-[4-(furan-2-yl)butan-2-yl]urea
CID 115571916
N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide
CID 61249906
N-[4-(furan-2-yl)butan-2-yl]-3-oxobutanamide
CID 61251024
N-ethyl-3-(furan-2-yl)propanamide
CID 60690706
4-[2-(ethylamino)-2-oxoethoxy]-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 42944232
2-[4-(furan-2-yl)butan-2-ylamino]butanoic acid
CID 64669169
N-[(2R)-4-(furan-2-yl)butan-2-yl]-3-methylbutanamide
CID 94153264
methyl 3-[4-(furan-2-yl)butan-2-ylamino]propanoate
CID 43478962
N-ethyl-2-(furan-2-yl)acetamide
CID 110484557
N-butyl-4-(furan-2-yl)butan-2-amine
CID 43182419
ethyl N-[4-(furan-2-yl)butan-2-yl]carbamate
CID 60651451
N-[4-(furan-2-yl)butan-2-yl]-4-(propan-2-ylamino)butanamide
CID 61249924

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide?
The IUPAC name of N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide (CID 43401748) is N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide.
What is the SMILES notation for N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide?
The canonical SMILES for N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide is CCNC(=O)CNC(C)CCc1ccco1.
What is the InChIKey of N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide?
The InChIKey is PJHJNHIWXJEQHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-3-13-12(15)9-14-10(2)6-7-11-5-4-8-16-11/h4-5,8,10,14H,3,6-7,9H2,1-2H3,(H,13,15).
What are the key properties of N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide?
N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide has a molecular weight of 224.30 g/mol, XLogP of 1.33, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide is sourced from PubChem (CID 43401748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).