2-(ethylamino)pent-4-enamide

C7H14N2O — CID 129260438

IUPAC2-(ethylamino)pent-4-enamide
SMILESC=CCC(NCC)C(N)=O
InChIInChI=1S/C7H14N2O/c1-3-5-6(7(8)10)9-4-2/h3,6,9H,1,4-5H2,2H3,(H2,8,10)
InChIKeyNNZGMEDPSTUVRJ-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.03
Rot. Bonds5

About 2-(ethylamino)pent-4-enamide

2-(ethylamino)pent-4-enamide (PubChem CID 129260438) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 2-(ethylamino)pent-4-enamide.

Molecular Properties

Compound Name2-(ethylamino)pent-4-enamide
PubChem CID129260438
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name2-(ethylamino)pent-4-enamide
SMILESC=CCC(NCC)C(N)=O
InChIInChI=1S/C7H14N2O/c1-3-5-6(7(8)10)9-4-2/h3,6,9H,1,4-5H2,2H3,(H2,8,10)
InChIKeyNNZGMEDPSTUVRJ-UHFFFAOYSA-N
XLogP0.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

methyl 2-(pentylamino)pent-4-enoate
CID 135182519
(2S)-6-amino-2-(ethylamino)hexanamide
CID 90248692
4-butan-2-ylsulfanyl-2-(ethylamino)butanamide
CID 63033750
2-(ethylamino)-6-methyl-5-oxoheptanamide
CID 174355389
2-(ethylamino)-4-pentoxybutanamide
CID 63034257
4-[butyl(methyl)amino]-2-(ethylamino)butanamide
CID 63029682
2-(ethylamino)-4-[ethyl(methyl)amino]butanamide
CID 63029588
prop-2-enyl 2-methylpent-4-enoate
CID 59817388
2-(ethylamino)-4-(4-hydroxybutan-2-ylsulfanyl)butanamide
CID 66135951
(Z,3R)-6-ethenyl-3-[2-(ethylamino)pent-4-enoylamino]oct-6-enoic acid
CID 129260491
2-(ethylamino)-4-(2-methoxyethoxy)butanamide
CID 63041176
nonyl 2-methylpent-4-enoate
CID 91695095

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)pent-4-enamide?
The IUPAC name of 2-(ethylamino)pent-4-enamide (CID 129260438) is 2-(ethylamino)pent-4-enamide.
What is the SMILES notation for 2-(ethylamino)pent-4-enamide?
The canonical SMILES for 2-(ethylamino)pent-4-enamide is C=CCC(NCC)C(N)=O.
What is the InChIKey of 2-(ethylamino)pent-4-enamide?
The InChIKey is NNZGMEDPSTUVRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-3-5-6(7(8)10)9-4-2/h3,6,9H,1,4-5H2,2H3,(H2,8,10).
What are the key properties of 2-(ethylamino)pent-4-enamide?
2-(ethylamino)pent-4-enamide has a molecular weight of 142.20 g/mol, XLogP of 0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)pent-4-enamide is sourced from PubChem (CID 129260438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).