2-methoxypropan-2-amine;oxolan-2-ylmethanamine

C9H22N2O2 — CID 143615334

IUPAC2-methoxypropan-2-amine;oxolan-2-ylmethanamine
SMILESCOC(C)(C)N.NCC1CCCO1
InChIInChI=1S/C5H11NO.C4H11NO/c6-4-5-2-1-3-7-5;1-4(2,5)6-3/h5H,1-4,6H2;5H2,1-3H3
InChIKeyOKYUFALSTIXPAI-UHFFFAOYSA-N
MW190.29 g/mol
LogP0.45
Rot. Bonds2

About 2-methoxypropan-2-amine;oxolan-2-ylmethanamine

2-methoxypropan-2-amine;oxolan-2-ylmethanamine (PubChem CID 143615334) has the molecular formula C9H22N2O2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-methoxypropan-2-amine;oxolan-2-ylmethanamine.

Molecular Properties

Compound Name2-methoxypropan-2-amine;oxolan-2-ylmethanamine
PubChem CID143615334
Molecular FormulaC9H22N2O2
Molecular Weight190.29 g/mol
Exact Mass190.17
IUPAC Name2-methoxypropan-2-amine;oxolan-2-ylmethanamine
SMILESCOC(C)(C)N.NCC1CCCO1
InChIInChI=1S/C5H11NO.C4H11NO/c6-4-5-2-1-3-7-5;1-4(2,5)6-3/h5H,1-4,6H2;5H2,1-3H3
InChIKeyOKYUFALSTIXPAI-UHFFFAOYSA-N
XLogP0.45
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

[(2R)-oxolan-2-yl]methanamine
CID 2734124
2-ethyl-2-(oxolan-2-ylmethyl)butan-1-amine
CID 62724509
2,2-dimethyl-3-[(2S)-oxolan-2-yl]propan-1-amine
CID 94565548
2,2-dimethyl-3-(oxolan-2-yl)propan-1-amine;hydrochloride
CID 122240151
2-cyclopropyl-1-(oxolan-2-yl)propan-2-amine
CID 82237698
2-[2-(2-methoxypropan-2-yloxy)ethyl]oxolane
CID 142450313
(2S)-2-(2,2-dimethylpropyl)oxolane
CID 58780523
(2R)-2-(2,2-dimethylpropyl)oxolane
CID 58780469
2-(2,2-dimethylpropyl)oxolane;ethane
CID 155737583
2-cyclopropyl-1-N-methyl-1-N-(oxolan-2-ylmethyl)propane-1,2-diamine
CID 61435769
[(2S)-oxolan-2-yl]methoxymethanamine
CID 126553312
2-[Di(tert-butyl)silyloxymethyl]tetrahydrofurane
CID 6329411

Frequently Asked Questions

What is the IUPAC name of 2-methoxypropan-2-amine;oxolan-2-ylmethanamine?
The IUPAC name of 2-methoxypropan-2-amine;oxolan-2-ylmethanamine (CID 143615334) is 2-methoxypropan-2-amine;oxolan-2-ylmethanamine.
What is the SMILES notation for 2-methoxypropan-2-amine;oxolan-2-ylmethanamine?
The canonical SMILES for 2-methoxypropan-2-amine;oxolan-2-ylmethanamine is COC(C)(C)N.NCC1CCCO1.
What is the InChIKey of 2-methoxypropan-2-amine;oxolan-2-ylmethanamine?
The InChIKey is OKYUFALSTIXPAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO.C4H11NO/c6-4-5-2-1-3-7-5;1-4(2,5)6-3/h5H,1-4,6H2;5H2,1-3H3.
What are the key properties of 2-methoxypropan-2-amine;oxolan-2-ylmethanamine?
2-methoxypropan-2-amine;oxolan-2-ylmethanamine has a molecular weight of 190.29 g/mol, XLogP of 0.45, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxypropan-2-amine;oxolan-2-ylmethanamine is sourced from PubChem (CID 143615334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).