3-[(methoxyamino)methoxy]propan-1-amine;thulium

C5H13N2O2Tm- — CID 149222211

IUPAC3-[(methoxyamino)methoxy]propan-1-amine;thulium
SMILESCONCOC[CH-]CN.[Tm]
InChIInChI=1S/C5H13N2O2.Tm/c1-8-7-5-9-4-2-3-6;/h2,7H,3-6H2,1H3;/q-1;
InChIKeyMJOKBVBRRVUTSO-UHFFFAOYSA-N
MW302.11 g/mol
LogP-0.73
Rot. Bonds6

About 3-[(methoxyamino)methoxy]propan-1-amine;thulium

3-[(methoxyamino)methoxy]propan-1-amine;thulium (PubChem CID 149222211) has the molecular formula C5H13N2O2Tm- and a molecular weight of 302.11 g/mol. Its IUPAC name is 3-[(methoxyamino)methoxy]propan-1-amine;thulium.

Molecular Properties

Compound Name3-[(methoxyamino)methoxy]propan-1-amine;thulium
PubChem CID149222211
Molecular FormulaC5H13N2O2Tm-
Molecular Weight302.11 g/mol
Exact Mass302.03
IUPAC Name3-[(methoxyamino)methoxy]propan-1-amine;thulium
SMILESCONCOC[CH-]CN.[Tm]
InChIInChI=1S/C5H13N2O2.Tm/c1-8-7-5-9-4-2-3-6;/h2,7H,3-6H2,1H3;/q-1;
InChIKeyMJOKBVBRRVUTSO-UHFFFAOYSA-N
XLogP-0.73
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.11
LogP ≤ 5-0.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N'-dimethoxyhexane-1,6-diamine
CID 58288617
(Z)-N'-methoxyprop-1-ene-1,3-diamine
CID 145013470
aminophosphonic acid;N-methoxyethanamine
CID 22609101
1-butoxybutane;tris(vanadium)
CID 162037301
N-methoxy-3-methylsulfanylpropan-1-amine
CID 79037579
N-methoxydodecan-1-amine
CID 14131600
N,2-dimethoxyethanamine
CID 19882916
4-[(methoxyamino)methyl]cyclohexan-1-amine
CID 163922118
(2-aminoethylamino) trimethyl silicate
CID 174823701
2,2,2-trifluoro-N-methoxyethanamine
CID 57444893
1-N'-methoxybutane-1,1,4-triamine
CID 174585201
methyl 3-(methoxyamino)-2-methylpropanoate
CID 60702587

Frequently Asked Questions

What is the IUPAC name of 3-[(methoxyamino)methoxy]propan-1-amine;thulium?
The IUPAC name of 3-[(methoxyamino)methoxy]propan-1-amine;thulium (CID 149222211) is 3-[(methoxyamino)methoxy]propan-1-amine;thulium.
What is the SMILES notation for 3-[(methoxyamino)methoxy]propan-1-amine;thulium?
The canonical SMILES for 3-[(methoxyamino)methoxy]propan-1-amine;thulium is CONCOC[CH-]CN.[Tm].
What is the InChIKey of 3-[(methoxyamino)methoxy]propan-1-amine;thulium?
The InChIKey is MJOKBVBRRVUTSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N2O2.Tm/c1-8-7-5-9-4-2-3-6;/h2,7H,3-6H2,1H3;/q-1;.
What are the key properties of 3-[(methoxyamino)methoxy]propan-1-amine;thulium?
3-[(methoxyamino)methoxy]propan-1-amine;thulium has a molecular weight of 302.11 g/mol, XLogP of -0.73, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(methoxyamino)methoxy]propan-1-amine;thulium is sourced from PubChem (CID 149222211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).