(Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide

C9H16N2O3 — CID 107362628

IUPAC(Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide
SMILESCC/C=C(/C)C(=O)NCC(O)C(N)=O
InChIInChI=1S/C9H16N2O3/c1-3-4-6(2)9(14)11-5-7(12)8(10)13/h4,7,12H,3,5H2,1-2H3,(H2,10,13)(H,11,14)/b6-4-
InChIKeyISBBJBBPEWPROL-XQRVVYSFSA-N
MW200.24 g/mol
LogP-0.69
Rot. Bonds5

About (Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide

(Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide (PubChem CID 107362628) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is (Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide.

Molecular Properties

Compound Name(Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide
PubChem CID107362628
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC Name(Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide
SMILESCC/C=C(/C)C(=O)NCC(O)C(N)=O
InChIInChI=1S/C9H16N2O3/c1-3-4-6(2)9(14)11-5-7(12)8(10)13/h4,7,12H,3,5H2,1-2H3,(H2,10,13)(H,11,14)/b6-4-
InChIKeyISBBJBBPEWPROL-XQRVVYSFSA-N
XLogP-0.69
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 5-0.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-2-methyl-N-(3,3,3-trifluoro-2-hydroxypropyl)pent-2-enamide
CID 103730634
(Z)-N-(3,3-difluoro-2-hydroxypropyl)-2-methylpent-2-enamide
CID 103769682
N-(3-amino-2-hydroxypropyl)-2,2,5,5-tetramethyl-1H-pyrrole-3-carboxamide
CID 14305434
2-ethyl-N-(2-hydroxypropyl)but-2-enamide
CID 54085350
(2E,6Z)-N-(2-hydroxypropyl)nona-2,6-dienamide
CID 57979023
N-(2-hydroxypropyl)nona-2,6-dienamide
CID 76694616
N-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-hydroxypropanamide
CID 87095014
(E)-N-(2-hydroxypropyl)-2-methylhex-2-enamide
CID 88374581
N-[3-[ethyl-[(Z)-pent-3-enyl]amino]-2-hydroxypropyl]prop-2-enamide
CID 90245544
N-(3,7-dimethylocta-2,6-dienyl)-2-hydroxypropanamide
CID 91339749
N-[2-(2-hydroxypropanoylamino)-2-methylpropyl]-2,3-dimethylpent-2-enamide
CID 123748304
(2E,3Z)-N-[(2R)-3-[(4Z,6Z)-3,8-dimethylidene-2,9-dihydroazonin-1-yl]-2-hydroxypropyl]-2-ethylidenehexa-3,5-dienamide
CID 130320478

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide?
The IUPAC name of (Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide (CID 107362628) is (Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide.
What is the SMILES notation for (Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide?
The canonical SMILES for (Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide is CC/C=C(/C)C(=O)NCC(O)C(N)=O.
What is the InChIKey of (Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide?
The InChIKey is ISBBJBBPEWPROL-XQRVVYSFSA-N. The full InChI is InChI=1S/C9H16N2O3/c1-3-4-6(2)9(14)11-5-7(12)8(10)13/h4,7,12H,3,5H2,1-2H3,(H2,10,13)(H,11,14)/b6-4-.
What are the key properties of (Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide?
(Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide has a molecular weight of 200.24 g/mol, XLogP of -0.69, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(3-amino-2-hydroxy-3-oxopropyl)-2-methylpent-2-enamide is sourced from PubChem (CID 107362628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).