2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide

C12H17N3O3 — CID 54870592

IUPAC2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide
SMILESNCC(=O)NCC(=O)N(Cc1ccco1)C1CC1
InChIInChI=1S/C12H17N3O3/c13-6-11(16)14-7-12(17)15(9-3-4-9)8-10-2-1-5-18-10/h1-2,5,9H,3-4,6-8,13H2,(H,14,16)
InChIKeyWENRUQCEPDNIFS-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.15
Rot. Bonds6

About 2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide

2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide (PubChem CID 54870592) has the molecular formula C12H17N3O3 and a molecular weight of 251.29 g/mol. Its IUPAC name is 2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide
PubChem CID54870592
Molecular FormulaC12H17N3O3
Molecular Weight251.29 g/mol
Exact Mass251.13
IUPAC Name2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide
SMILESNCC(=O)NCC(=O)N(Cc1ccco1)C1CC1
InChIInChI=1S/C12H17N3O3/c13-6-11(16)14-7-12(17)15(9-3-4-9)8-10-2-1-5-18-10/h1-2,5,9H,3-4,6-8,13H2,(H,14,16)
InChIKeyWENRUQCEPDNIFS-UHFFFAOYSA-N
XLogP-0.15
TPSA88.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-[cyclopropyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]acetamide
CID 54871939
(2S)-2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]-3-methylbutanamide
CID 82963604
N-cyclopropyl-N-(furan-2-ylmethyl)benzamide
CID 47022966
2-amino-N-[2-[furan-2-ylmethyl(2,2,2-trifluoroethyl)amino]-2-oxoethyl]acetamide
CID 60937580
N-cyclopropyl-N-(furan-2-ylmethyl)-3-sulfanylpropanamide
CID 107026655
2-amino-N-[2-[2-cyanoethyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide
CID 54874146
N-cyclopropyl-N-(furan-2-ylmethyl)-4-hydroxybutanamide
CID 79200570
3-(aminomethyl)-N-cyclopropyl-N-(furan-2-ylmethyl)pentanamide
CID 81087169
N-(2-amino-2-sulfanylideneethyl)-N'-cyclopropyl-N'-(furan-2-ylmethyl)oxamide
CID 55003593
N-[2-[cyclopentyl(furan-2-ylmethyl)amino]-2-oxoethyl]thiophene-3-carboxamide
CID 75509612
N-cyclopropyl-N-(furan-2-ylmethyl)-4-iodobenzamide
CID 60731680
2-(2-aminophenoxy)-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide
CID 61107416

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide?
The IUPAC name of 2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide (CID 54870592) is 2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide is NCC(=O)NCC(=O)N(Cc1ccco1)C1CC1.
What is the InChIKey of 2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide?
The InChIKey is WENRUQCEPDNIFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O3/c13-6-11(16)14-7-12(17)15(9-3-4-9)8-10-2-1-5-18-10/h1-2,5,9H,3-4,6-8,13H2,(H,14,16).
What are the key properties of 2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide?
2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide has a molecular weight of 251.29 g/mol, XLogP of -0.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]acetamide is sourced from PubChem (CID 54870592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).