2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide

C8H15N5O2 — CID 82838011

IUPAC2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide
SMILES[N-]=[N+]=NCCNC(C(N)=O)C1CCCO1
InChIInChI=1S/C8H15N5O2/c9-8(14)7(6-2-1-5-15-6)11-3-4-12-13-10/h6-7,11H,1-5H2,(H2,9,14)
InChIKeyNGBGERBMBVSAGH-UHFFFAOYSA-N
MW213.24 g/mol
LogP-0.08
Rot. Bonds6

About 2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide

2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide (PubChem CID 82838011) has the molecular formula C8H15N5O2 and a molecular weight of 213.24 g/mol. Its IUPAC name is 2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide
PubChem CID82838011
Molecular FormulaC8H15N5O2
Molecular Weight213.24 g/mol
Exact Mass213.12
IUPAC Name2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide
SMILES[N-]=[N+]=NCCNC(C(N)=O)C1CCCO1
InChIInChI=1S/C8H15N5O2/c9-8(14)7(6-2-1-5-15-6)11-3-4-12-13-10/h6-7,11H,1-5H2,(H2,9,14)
InChIKeyNGBGERBMBVSAGH-UHFFFAOYSA-N
XLogP-0.08
TPSA113.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

2-(oxolan-2-yl)-2-(oxolan-2-ylmethylamino)acetamide
CID 82837199
2-[2-(diethylamino)ethylamino]-2-(oxolan-2-yl)acetamide
CID 82837527
2-(2-azidoethylamino)-2-(4-methylcyclohexyl)acetamide
CID 66190841
2-(cyclopropylamino)-2-(oxolan-2-yl)acetamide
CID 82837879
3-azido-2-(2-azidoethylamino)propanamide
CID 66429441
methyl 2-(3-azidopropylamino)-2-(oxan-3-yl)acetate
CID 66189126
2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid
CID 82838234
2-hydroxy-2-(oxolan-2-yl)acetamide
CID 82837458
N-(4-azidobutyl)-3-(oxolan-2-yl)propanamide
CID 106386302
N-(2-azidoethyl)-1-(oxolan-2-yl)methanesulfonamide
CID 63247487
2-(2-azidoethylamino)-2-cyclohex-3-en-1-ylacetic acid
CID 66190204
2-(2-azidoethylamino)-4,4-dimethylpentanamide
CID 66190065

Frequently Asked Questions

What is the IUPAC name of 2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide?
The IUPAC name of 2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide (CID 82838011) is 2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide.
What is the SMILES notation for 2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide?
The canonical SMILES for 2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide is [N-]=[N+]=NCCNC(C(N)=O)C1CCCO1.
What is the InChIKey of 2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide?
The InChIKey is NGBGERBMBVSAGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O2/c9-8(14)7(6-2-1-5-15-6)11-3-4-12-13-10/h6-7,11H,1-5H2,(H2,9,14).
What are the key properties of 2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide?
2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide has a molecular weight of 213.24 g/mol, XLogP of -0.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-azidoethylamino)-2-(oxolan-2-yl)acetamide is sourced from PubChem (CID 82838011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).