(E)-4-amino-3-(methylamino)but-3-enamide

C5H11N3O — CID 118973901

IUPAC(E)-4-amino-3-(methylamino)but-3-enamide
SMILESCN/C(=C/N)CC(N)=O
InChIInChI=1S/C5H11N3O/c1-8-4(3-6)2-5(7)9/h3,8H,2,6H2,1H3,(H2,7,9)/b4-3+
InChIKeyGNQRPPZIRCKTPE-ONEGZZNKSA-N
MW129.16 g/mol
LogP-1.12
Rot. Bonds3

About (E)-4-amino-3-(methylamino)but-3-enamide

(E)-4-amino-3-(methylamino)but-3-enamide (PubChem CID 118973901) has the molecular formula C5H11N3O and a molecular weight of 129.16 g/mol. Its IUPAC name is (E)-4-amino-3-(methylamino)but-3-enamide.

Molecular Properties

Compound Name(E)-4-amino-3-(methylamino)but-3-enamide
PubChem CID118973901
Molecular FormulaC5H11N3O
Molecular Weight129.16 g/mol
Exact Mass129.09
IUPAC Name(E)-4-amino-3-(methylamino)but-3-enamide
SMILESCN/C(=C/N)CC(N)=O
InChIInChI=1S/C5H11N3O/c1-8-4(3-6)2-5(7)9/h3,8H,2,6H2,1H3,(H2,7,9)/b4-3+
InChIKeyGNQRPPZIRCKTPE-ONEGZZNKSA-N
XLogP-1.12
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-1.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-methyl-3-(methylamino)but-3-enamide
CID 143134494
4-Amino-1,3-dihydropyrrol-2-one
CID 276755
N-(3-aminobut-3-enyl)propanamide
CID 137412908
N-(4-aminobut-1-en-2-yl)acetamide
CID 138658900
2-(1,4-Dihydropyridin-2-yl)acetamide
CID 139632179
3-[4-[Butyl(methyl)amino]but-1-en-2-ylamino]propanamide;ethane
CID 142174077
but-1-en-2-amine;N-methylpropanamide
CID 143544208
(Z)-2-N-methylprop-1-ene-1,2-diamine;propanamide
CID 145493080
N-ethyl-3-(ethylamino)but-3-enamide
CID 148931324
3-amino-N-methylbut-3-enamide
CID 155242589
3-amino-N-[(E)-but-1-enyl]propanamide
CID 156281370
N-[2-(1lambda3-ioda-2,5-diazacyclopenta-1,3-dien-3-yl)ethyl]acetamide
CID 163871385

Frequently Asked Questions

What is the IUPAC name of (E)-4-amino-3-(methylamino)but-3-enamide?
The IUPAC name of (E)-4-amino-3-(methylamino)but-3-enamide (CID 118973901) is (E)-4-amino-3-(methylamino)but-3-enamide.
What is the SMILES notation for (E)-4-amino-3-(methylamino)but-3-enamide?
The canonical SMILES for (E)-4-amino-3-(methylamino)but-3-enamide is CN/C(=C/N)CC(N)=O.
What is the InChIKey of (E)-4-amino-3-(methylamino)but-3-enamide?
The InChIKey is GNQRPPZIRCKTPE-ONEGZZNKSA-N. The full InChI is InChI=1S/C5H11N3O/c1-8-4(3-6)2-5(7)9/h3,8H,2,6H2,1H3,(H2,7,9)/b4-3+.
What are the key properties of (E)-4-amino-3-(methylamino)but-3-enamide?
(E)-4-amino-3-(methylamino)but-3-enamide has a molecular weight of 129.16 g/mol, XLogP of -1.12, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-amino-3-(methylamino)but-3-enamide is sourced from PubChem (CID 118973901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).