2-amino-N-hydroxy-N-methylpent-4-ynamide

C6H10N2O2 — CID 130884466

IUPAC2-amino-N-hydroxy-N-methylpent-4-ynamide
SMILESC#CCC(N)C(=O)N(C)O
InChIInChI=1S/C6H10N2O2/c1-3-4-5(7)6(9)8(2)10/h1,5,10H,4,7H2,2H3
InChIKeyDFFOMMYYOMSOSM-UHFFFAOYSA-N
MW142.16 g/mol
LogP-0.82
Rot. Bonds2

About 2-amino-N-hydroxy-N-methylpent-4-ynamide

2-amino-N-hydroxy-N-methylpent-4-ynamide (PubChem CID 130884466) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is 2-amino-N-hydroxy-N-methylpent-4-ynamide.

Molecular Properties

Compound Name2-amino-N-hydroxy-N-methylpent-4-ynamide
PubChem CID130884466
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name2-amino-N-hydroxy-N-methylpent-4-ynamide
SMILESC#CCC(N)C(=O)N(C)O
InChIInChI=1S/C6H10N2O2/c1-3-4-5(7)6(9)8(2)10/h1,5,10H,4,7H2,2H3
InChIKeyDFFOMMYYOMSOSM-UHFFFAOYSA-N
XLogP-0.82
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-methyl-N-(1-methylsulfanylpropan-2-yl)pent-4-ynamide
CID 112659346
2-amino-N-(2-amino-2-oxoethyl)-N-ethylpent-4-ynamide
CID 103101958
(2R)-2-amino-N-hydroxy-N-methylpentanamide
CID 131057070
2-aminopent-4-ynoic acid;hydrochloride
CID 53229946
tert-butyl (2S)-2-aminopent-4-ynoate
CID 44754800
(2S)-2-amino-N-propylpent-4-ynamide
CID 82668022
2-amino-N-(1-hydroxy-3-methylpentan-3-yl)pent-4-ynamide
CID 106176289
(3S)-3-amino-1-phosphorosohex-5-yn-2-one
CID 129211157
4-aminododec-1-yn-5-one
CID 116606528
(2-methylpropan-2-yl)oxycarbonyl 2-aminopent-4-ynoate
CID 56982899
2-amino-N-[2-(2-hydroxyethoxy)ethyl]pent-4-ynamide
CID 115563193
2-amino-N-(5-amino-5-oxopentyl)pent-4-ynamide
CID 106235864

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-hydroxy-N-methylpent-4-ynamide?
The IUPAC name of 2-amino-N-hydroxy-N-methylpent-4-ynamide (CID 130884466) is 2-amino-N-hydroxy-N-methylpent-4-ynamide.
What is the SMILES notation for 2-amino-N-hydroxy-N-methylpent-4-ynamide?
The canonical SMILES for 2-amino-N-hydroxy-N-methylpent-4-ynamide is C#CCC(N)C(=O)N(C)O.
What is the InChIKey of 2-amino-N-hydroxy-N-methylpent-4-ynamide?
The InChIKey is DFFOMMYYOMSOSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-3-4-5(7)6(9)8(2)10/h1,5,10H,4,7H2,2H3.
What are the key properties of 2-amino-N-hydroxy-N-methylpent-4-ynamide?
2-amino-N-hydroxy-N-methylpent-4-ynamide has a molecular weight of 142.16 g/mol, XLogP of -0.82, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-hydroxy-N-methylpent-4-ynamide is sourced from PubChem (CID 130884466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).