N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide

C12H19N3O3 — CID 60638480

IUPACN-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide
SMILESCCNC(=O)NC(=O)C(C)NCCc1ccco1
InChIInChI=1S/C12H19N3O3/c1-3-13-12(17)15-11(16)9(2)14-7-6-10-5-4-8-18-10/h4-5,8-9,14H,3,6-7H2,1-2H3,(H2,13,15,16,17)
InChIKeyCIEVEOKHBMHMTD-UHFFFAOYSA-N
MW253.30 g/mol
LogP0.65
Rot. Bonds6

About N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide

N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide (PubChem CID 60638480) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide
PubChem CID60638480
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC NameN-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide
SMILESCCNC(=O)NC(=O)C(C)NCCc1ccco1
InChIInChI=1S/C12H19N3O3/c1-3-13-12(17)15-11(16)9(2)14-7-6-10-5-4-8-18-10/h4-5,8-9,14H,3,6-7H2,1-2H3,(H2,13,15,16,17)
InChIKeyCIEVEOKHBMHMTD-UHFFFAOYSA-N
XLogP0.65
TPSA83.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-tert-butyl-2-[2-(furan-2-yl)ethylamino]propanamide
CID 60676843
2-[2-(furan-2-yl)ethylamino]-N-phenylpropanamide
CID 60638620
N-(ethylcarbamoyl)-2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]propanamide
CID 106399971
1-ethyl-3-[4-(furan-2-yl)butan-2-yl]urea
CID 115571916
N-(ethylcarbamoyl)-2-(2-pyridin-4-ylethylamino)propanamide
CID 60902698
N-(ethylcarbamoyl)-2-[2-(3-methylphenyl)ethylamino]propanamide
CID 62315197
N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide
CID 43401425
(2S)-2-amino-N-[2-(furan-2-yl)ethyl]propanamide
CID 61147120
N-(ethylcarbamoyl)-2-(2-hydroxyethylamino)propanamide
CID 43389341
3-[2-(furan-2-yl)ethylamino]-2-methyl-3-oxopropanoic acid
CID 114897735
2-[2-(furan-2-yl)ethylcarbamoylamino]propanoic acid
CID 61471341
2-(2-aminoethylamino)-N-(furan-2-ylmethyl)propanamide
CID 62139964

Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide?
The IUPAC name of N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide (CID 60638480) is N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide is CCNC(=O)NC(=O)C(C)NCCc1ccco1.
What is the InChIKey of N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide?
The InChIKey is CIEVEOKHBMHMTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-3-13-12(17)15-11(16)9(2)14-7-6-10-5-4-8-18-10/h4-5,8-9,14H,3,6-7H2,1-2H3,(H2,13,15,16,17).
What are the key properties of N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide?
N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide has a molecular weight of 253.30 g/mol, XLogP of 0.65, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide is sourced from PubChem (CID 60638480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).