1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine

C10H22N4O2 — CID 167338786

IUPAC1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)COCOCC(C)(C)N=[N+]=[N-]
InChIInChI=1S/C10H22N4O2/c1-9(2,12-5)6-15-8-16-7-10(3,4)13-14-11/h12H,6-8H2,1-5H3
InChIKeyNBWRWTMNHOAKDU-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.06
Rot. Bonds8

About 1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine

1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine (PubChem CID 167338786) has the molecular formula C10H22N4O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine.

Molecular Properties

Compound Name1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine
PubChem CID167338786
Molecular FormulaC10H22N4O2
Molecular Weight230.31 g/mol
Exact Mass230.17
IUPAC Name1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)COCOCC(C)(C)N=[N+]=[N-]
InChIInChI=1S/C10H22N4O2/c1-9(2,12-5)6-15-8-16-7-10(3,4)13-14-11/h12H,6-8H2,1-5H3
InChIKeyNBWRWTMNHOAKDU-UHFFFAOYSA-N
XLogP2.06
TPSA79.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.06
H-Bond Donors ≤ 51
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': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine?
The IUPAC name of 1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine (CID 167338786) is 1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine.
What is the SMILES notation for 1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine?
The canonical SMILES for 1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine is CNC(C)(C)COCOCC(C)(C)N=[N+]=[N-].
What is the InChIKey of 1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine?
The InChIKey is NBWRWTMNHOAKDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O2/c1-9(2,12-5)6-15-8-16-7-10(3,4)13-14-11/h12H,6-8H2,1-5H3.
What are the key properties of 1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine?
1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine has a molecular weight of 230.31 g/mol, XLogP of 2.06, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-azido-2-methylpropoxy)methoxy]-N,2-dimethylpropan-2-amine is sourced from PubChem (CID 167338786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).