N-ethyl-3-(ethylamino)but-3-enamide

C8H16N2O — CID 148931324

IUPACN-ethyl-3-(ethylamino)but-3-enamide
SMILESC=C(CC(=O)NCC)NCC
InChIInChI=1S/C8H16N2O/c1-4-9-7(3)6-8(11)10-5-2/h9H,3-6H2,1-2H3,(H,10,11)
InChIKeyPLZTUHAFDGMNTJ-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.64
Rot. Bonds5

About N-ethyl-3-(ethylamino)but-3-enamide

N-ethyl-3-(ethylamino)but-3-enamide (PubChem CID 148931324) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N-ethyl-3-(ethylamino)but-3-enamide.

Molecular Properties

Compound NameN-ethyl-3-(ethylamino)but-3-enamide
PubChem CID148931324
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN-ethyl-3-(ethylamino)but-3-enamide
SMILESC=C(CC(=O)NCC)NCC
InChIInChI=1S/C8H16N2O/c1-4-9-7(3)6-8(11)10-5-2/h9H,3-6H2,1-2H3,(H,10,11)
InChIKeyPLZTUHAFDGMNTJ-UHFFFAOYSA-N
XLogP0.64
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-N-methyl-3-(methylamino)but-3-enamide
CID 143134494
N-tert-butyl-N-ethyl-3-(prop-1-en-2-ylamino)propanamide
CID 88911258
3-amino-N-[(1S)-1-phosphanylethyl]but-3-enamide
CID 88926726
N-[4-(prop-1-en-2-ylamino)butyl]acetamide
CID 88972536
N-[3-[methyl-[3-(prop-1-en-2-ylamino)propyl]amino]propyl]acetamide
CID 89105810
(Z)-3-[[(E)-but-2-en-2-yl]amino]-N-methylpent-3-enamide
CID 89224066
(Z)-3-[[(E)-but-2-en-2-yl]amino]-N-propylpent-3-enamide
CID 89224177
N-methyl-N-[3-(prop-1-en-2-ylamino)butyl]acetamide
CID 90245574
N-[2-[[(Z)-2-aminobut-1-enyl]amino]ethyl]acetamide
CID 90382326
2-methyl-N-[3-[3-(3-methylbut-1-en-2-ylamino)propyl-[3-(2-methylpropanoylamino)propyl]amino]propyl]propanamide
CID 118136023
(E)-4-amino-3-(methylamino)but-3-enamide
CID 118973901
3-methyl-N-[3-(4-methylpent-1-en-2-ylamino)propyl]butanamide
CID 122664372

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(ethylamino)but-3-enamide?
The IUPAC name of N-ethyl-3-(ethylamino)but-3-enamide (CID 148931324) is N-ethyl-3-(ethylamino)but-3-enamide.
What is the SMILES notation for N-ethyl-3-(ethylamino)but-3-enamide?
The canonical SMILES for N-ethyl-3-(ethylamino)but-3-enamide is C=C(CC(=O)NCC)NCC.
What is the InChIKey of N-ethyl-3-(ethylamino)but-3-enamide?
The InChIKey is PLZTUHAFDGMNTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-4-9-7(3)6-8(11)10-5-2/h9H,3-6H2,1-2H3,(H,10,11).
What are the key properties of N-ethyl-3-(ethylamino)but-3-enamide?
N-ethyl-3-(ethylamino)but-3-enamide has a molecular weight of 156.23 g/mol, XLogP of 0.64, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(ethylamino)but-3-enamide is sourced from PubChem (CID 148931324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).