(Z)-3-amino-N,N-diethylbut-2-enamide

C8H16N2O — CID 15758189

IUPAC(Z)-3-amino-N,N-diethylbut-2-enamide
SMILESCCN(CC)C(=O)/C=C(/C)N
InChIInChI=1S/C8H16N2O/c1-4-10(5-2)8(11)6-7(3)9/h6H,4-5,9H2,1-3H3/b7-6-
InChIKeyYTEIZWQUKVVVJL-SREVYHEPSA-N
MW156.23 g/mol
LogP0.72
Rot. Bonds3

About (Z)-3-amino-N,N-diethylbut-2-enamide

(Z)-3-amino-N,N-diethylbut-2-enamide (PubChem CID 15758189) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is (Z)-3-amino-N,N-diethylbut-2-enamide.

Molecular Properties

Compound Name(Z)-3-amino-N,N-diethylbut-2-enamide
PubChem CID15758189
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name(Z)-3-amino-N,N-diethylbut-2-enamide
SMILESCCN(CC)C(=O)/C=C(/C)N
InChIInChI=1S/C8H16N2O/c1-4-10(5-2)8(11)6-7(3)9/h6H,4-5,9H2,1-3H3/b7-6-
InChIKeyYTEIZWQUKVVVJL-SREVYHEPSA-N
XLogP0.72
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2(1H)-Pyridinone, 4-(dimethylamino)-6-methyl-
CID 3071508
4-Amino-1,6-dimethyl-1,2-dihydropyridin-2-one
CID 2785661
(2Z)-3-amino-1-piperidylbut-2-en-1-one
CID 768586
1,7-Dimethyl-1,2,3,4-tetrahydro-5H-1,4-diazepin-5-one
CID 371092
(E)-3-amino-1-piperidin-1-ylbut-2-en-1-one
CID 98282160
(Z)-3-(butylamino)-N,N-dimethylbut-2-enamide
CID 11435354
(Z)-3-dimethylamino-N,N-dimethylbut-2-enamide
CID 12406926
(Z)-N-butyl-3-(butylamino)but-2-enamide
CID 12672794
(E)-3-(carbamoyldiazenyl)-N,N-diethylbut-2-enamide
CID 135083693
N,N-dimethyl-3-(isobutylamino)-2-butenamide
CID 146674905
N,N-diethyl-3-(isobutylamino)-2-butenamide
CID 146674914
(z)-N,N-diethyl-3-ureidobut-2-enamide
CID 154573970

Frequently Asked Questions

What is the IUPAC name of (Z)-3-amino-N,N-diethylbut-2-enamide?
The IUPAC name of (Z)-3-amino-N,N-diethylbut-2-enamide (CID 15758189) is (Z)-3-amino-N,N-diethylbut-2-enamide.
What is the SMILES notation for (Z)-3-amino-N,N-diethylbut-2-enamide?
The canonical SMILES for (Z)-3-amino-N,N-diethylbut-2-enamide is CCN(CC)C(=O)/C=C(/C)N.
What is the InChIKey of (Z)-3-amino-N,N-diethylbut-2-enamide?
The InChIKey is YTEIZWQUKVVVJL-SREVYHEPSA-N. The full InChI is InChI=1S/C8H16N2O/c1-4-10(5-2)8(11)6-7(3)9/h6H,4-5,9H2,1-3H3/b7-6-.
What are the key properties of (Z)-3-amino-N,N-diethylbut-2-enamide?
(Z)-3-amino-N,N-diethylbut-2-enamide has a molecular weight of 156.23 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-N,N-diethylbut-2-enamide is sourced from PubChem (CID 15758189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).