2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide

C13H22N2O2 — CID 60946987

IUPAC2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide
SMILESCCC(C)NCC(=O)N(CC)Cc1ccco1
InChIInChI=1S/C13H22N2O2/c1-4-11(3)14-9-13(16)15(5-2)10-12-7-6-8-17-12/h6-8,11,14H,4-5,9-10H2,1-3H3
InChIKeySXFROGMNQJDAMB-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.02
Rot. Bonds7

About 2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide

2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide (PubChem CID 60946987) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide
PubChem CID60946987
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide
SMILESCCC(C)NCC(=O)N(CC)Cc1ccco1
InChIInChI=1S/C13H22N2O2/c1-4-11(3)14-9-13(16)15(5-2)10-12-7-6-8-17-12/h6-8,11,14H,4-5,9-10H2,1-3H3
InChIKeySXFROGMNQJDAMB-UHFFFAOYSA-N
XLogP2.02
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(butan-2-ylamino)-3-(furan-2-yl)propan-2-one
CID 116556195
N-ethyl-N-(furan-2-ylmethyl)-2-sulfanylpropanamide
CID 107024393
N,N-diethyl-2-[1-(furan-2-yl)ethylamino]acetamide
CID 43401823
propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate
CID 116654523
1-ethyl-1-(furan-2-ylmethyl)-3,3-dimethylurea
CID 115581572
N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 42767360
N,N-bis(furan-2-ylmethyl)-2-(prop-2-ynylamino)acetamide
CID 78915168
3-[ethyl-[ethyl(furan-2-ylmethyl)carbamoyl]amino]-2-methylpropanoic acid
CID 62853925
N-ethyl-N-(furan-2-ylmethyl)-2-hydroxy-2-methylpropanamide
CID 103429605
3-[ethyl-[ethyl(furan-2-ylmethyl)carbamoyl]amino]propanoic acid
CID 61420879
2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide
CID 60938301
3-[[ethyl(furan-2-ylmethyl)carbamoyl]amino]-2,2,3-trimethylbutanoic acid
CID 65266487

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide (CID 60946987) is 2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide is CCC(C)NCC(=O)N(CC)Cc1ccco1.
What is the InChIKey of 2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide?
The InChIKey is SXFROGMNQJDAMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-4-11(3)14-9-13(16)15(5-2)10-12-7-6-8-17-12/h6-8,11,14H,4-5,9-10H2,1-3H3.
What are the key properties of 2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide?
2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide has a molecular weight of 238.33 g/mol, XLogP of 2.02, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 60946987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).