2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide

C11H22N2O2 — CID 106188129

IUPAC2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide
SMILESC=CCC(N)C(=O)NC(C)(C)C(C)(C)O
InChIInChI=1S/C11H22N2O2/c1-6-7-8(12)9(14)13-10(2,3)11(4,5)15/h6,8,15H,1,7,12H2,2-5H3,(H,13,14)
InChIKeyMFPMUBRIOBRSTK-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.56
Rot. Bonds5

About 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide

2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide (PubChem CID 106188129) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide.

Molecular Properties

Compound Name2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide
PubChem CID106188129
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide
SMILESC=CCC(N)C(=O)NC(C)(C)C(C)(C)O
InChIInChI=1S/C11H22N2O2/c1-6-7-8(12)9(14)13-10(2,3)11(4,5)15/h6,8,15H,1,7,12H2,2-5H3,(H,13,14)
InChIKeyMFPMUBRIOBRSTK-UHFFFAOYSA-N
XLogP0.56
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)butanediamide
CID 106187946
2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pentanamide
CID 106188088
2-amino-N-(3,3-dimethylbutyl)pent-4-enamide
CID 112704204
methyl 2-aminopent-4-enoate
CID 10877146
2-amino-N-[(2S)-2-hydroxypropyl]pent-4-enamide
CID 107221169
ethane;methyl (2S)-2-aminopent-4-enoate
CID 143525314
4-amino-2-methylhepta-1,6-dien-3-one
CID 116606914
tert-butyl 2-aminopent-4-enoate;hydrochloride
CID 139035813
2-amino-N-(6-hydroxyhexyl)pent-4-enamide
CID 107842505
4-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-methylbutanamide
CID 106187972
2-amino-N-(2,2-difluoro-3-hydroxypropyl)pent-4-enamide
CID 106176820
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-methyl-3-(methylamino)propanamide
CID 106188163

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide?
The IUPAC name of 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide (CID 106188129) is 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide.
What is the SMILES notation for 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide?
The canonical SMILES for 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide is C=CCC(N)C(=O)NC(C)(C)C(C)(C)O.
What is the InChIKey of 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide?
The InChIKey is MFPMUBRIOBRSTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-6-7-8(12)9(14)13-10(2,3)11(4,5)15/h6,8,15H,1,7,12H2,2-5H3,(H,13,14).
What are the key properties of 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide?
2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide has a molecular weight of 214.31 g/mol, XLogP of 0.56, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pent-4-enamide is sourced from PubChem (CID 106188129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).