N-methoxy-1-propan-2-yloxypropan-2-amine

C7H17NO2 — CID 130737609

IUPACN-methoxy-1-propan-2-yloxypropan-2-amine
SMILESCONC(C)COC(C)C
InChIInChI=1S/C7H17NO2/c1-6(2)10-5-7(3)8-9-4/h6-8H,5H2,1-4H3
InChIKeyMSMINAGLUZYBJL-UHFFFAOYSA-N
MW147.22 g/mol
LogP0.95
Rot. Bonds5

About N-methoxy-1-propan-2-yloxypropan-2-amine

N-methoxy-1-propan-2-yloxypropan-2-amine (PubChem CID 130737609) has the molecular formula C7H17NO2 and a molecular weight of 147.22 g/mol. Its IUPAC name is N-methoxy-1-propan-2-yloxypropan-2-amine.

Molecular Properties

Compound NameN-methoxy-1-propan-2-yloxypropan-2-amine
PubChem CID130737609
Molecular FormulaC7H17NO2
Molecular Weight147.22 g/mol
Exact Mass147.13
IUPAC NameN-methoxy-1-propan-2-yloxypropan-2-amine
SMILESCONC(C)COC(C)C
InChIInChI=1S/C7H17NO2/c1-6(2)10-5-7(3)8-9-4/h6-8H,5H2,1-4H3
InChIKeyMSMINAGLUZYBJL-UHFFFAOYSA-N
XLogP0.95
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-N-methoxypropan-2-amine
CID 55298441
ethane;2-methyl-1-propan-2-yloxypropane
CID 143798682
ethane;2-methyl-1-propan-2-yloxypropane
CID 145385710
(2S)-1-cyclohexyl-N-methoxypropan-2-amine
CID 54506563
1-methoxy-N-propan-2-yl-3-propan-2-yloxypropan-2-amine
CID 176738285
1-methoxy-N-(2-propan-2-yloxyethyl)propan-2-amine
CID 60688575
(2S)-1-methoxy-3-propan-2-yloxypropan-2-amine
CID 164877074
1-methoxy-2,4-bis(methoxymethyl)-5-propan-2-yloxypentane
CID 134479916
1-methoxy-2-methyl-3-[2-methyl-3-(2-methyl-3-propan-2-yloxypropoxy)propoxy]propane
CID 155228803
N,2-dimethyl-3-propan-2-yloxypropan-1-amine
CID 103635829
N,1,1-trimethoxypropan-2-amine
CID 82706992
(2R)-1-[[(2R)-2-hydroxy-3-propan-2-yloxypropyl]amino]-3-propan-2-yloxypropan-2-ol
CID 38999921

Frequently Asked Questions

What is the IUPAC name of N-methoxy-1-propan-2-yloxypropan-2-amine?
The IUPAC name of N-methoxy-1-propan-2-yloxypropan-2-amine (CID 130737609) is N-methoxy-1-propan-2-yloxypropan-2-amine.
What is the SMILES notation for N-methoxy-1-propan-2-yloxypropan-2-amine?
The canonical SMILES for N-methoxy-1-propan-2-yloxypropan-2-amine is CONC(C)COC(C)C.
What is the InChIKey of N-methoxy-1-propan-2-yloxypropan-2-amine?
The InChIKey is MSMINAGLUZYBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO2/c1-6(2)10-5-7(3)8-9-4/h6-8H,5H2,1-4H3.
What are the key properties of N-methoxy-1-propan-2-yloxypropan-2-amine?
N-methoxy-1-propan-2-yloxypropan-2-amine has a molecular weight of 147.22 g/mol, XLogP of 0.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-1-propan-2-yloxypropan-2-amine is sourced from PubChem (CID 130737609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).