1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol

C9H21NO3 — CID 64812317

IUPAC1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol
SMILESCOCCOCCCC(C)(O)CN
InChIInChI=1S/C9H21NO3/c1-9(11,8-10)4-3-5-13-7-6-12-2/h11H,3-8,10H2,1-2H3
InChIKeyKZWLVPSWKFORRN-UHFFFAOYSA-N
MW191.27 g/mol
LogP0.14
Rot. Bonds8

About 1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol

1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol (PubChem CID 64812317) has the molecular formula C9H21NO3 and a molecular weight of 191.27 g/mol. Its IUPAC name is 1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol.

Molecular Properties

Compound Name1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol
PubChem CID64812317
Molecular FormulaC9H21NO3
Molecular Weight191.27 g/mol
Exact Mass191.15
IUPAC Name1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol
SMILESCOCCOCCCC(C)(O)CN
InChIInChI=1S/C9H21NO3/c1-9(11,8-10)4-3-5-13-7-6-12-2/h11H,3-8,10H2,1-2H3
InChIKeyKZWLVPSWKFORRN-UHFFFAOYSA-N
XLogP0.14
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-amino-6-(2-ethoxyethoxy)-2-methylhexan-2-ol
CID 64814822
3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropan-1-amine
CID 103406340
2-amino-5-[3-(2-methoxyethoxy)propoxy]-2-methylpentan-1-ol
CID 103407415
3-(aminomethyl)-6-methoxy-2,2-dimethylhexan-3-ol
CID 114852616
N'-hydroxy-5-[2-(2-methoxyethoxy)ethoxy]-2,2-dimethylpentanimidamide
CID 104562250
N'-hydroxy-5-(2-methoxyethoxy)-2,2-dimethylpentanimidamide
CID 77063432
6-methoxy-3-methylhexan-3-ol
CID 114851780
1-(2-methoxyethoxy)-4-[4-(2-methoxyethoxy)butoxy]butane
CID 58114561
3-ethyl-6-(2-methoxyethoxy)hexan-3-amine
CID 103414969
5-[2-(2-methoxyethoxy)ethoxy]-2-methyl-2-(methylamino)pentanamide
CID 104565427
2-ethyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol
CID 103415225
2-amino-5-[3-(2-methoxyethoxy)propoxy]-2-methylpentanenitrile
CID 103404479

Frequently Asked Questions

What is the IUPAC name of 1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol?
The IUPAC name of 1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol (CID 64812317) is 1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol.
What is the SMILES notation for 1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol?
The canonical SMILES for 1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol is COCCOCCCC(C)(O)CN.
What is the InChIKey of 1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol?
The InChIKey is KZWLVPSWKFORRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO3/c1-9(11,8-10)4-3-5-13-7-6-12-2/h11H,3-8,10H2,1-2H3.
What are the key properties of 1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol?
1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol has a molecular weight of 191.27 g/mol, XLogP of 0.14, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-5-(2-methoxyethoxy)-2-methylpentan-2-ol is sourced from PubChem (CID 64812317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).