3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol

C9H19NO2 — CID 116501365

IUPAC3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol
SMILESCOCC(C)CNC1CC(O)C1
InChIInChI=1S/C9H19NO2/c1-7(6-12-2)5-10-8-3-9(11)4-8/h7-11H,3-6H2,1-2H3
InChIKeyKKFWZFVWCAXDQT-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.38
Rot. Bonds5

About 3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol

3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol (PubChem CID 116501365) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol.

Molecular Properties

Compound Name3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol
PubChem CID116501365
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol
SMILESCOCC(C)CNC1CC(O)C1
InChIInChI=1S/C9H19NO2/c1-7(6-12-2)5-10-8-3-9(11)4-8/h7-11H,3-6H2,1-2H3
InChIKeyKKFWZFVWCAXDQT-UHFFFAOYSA-N
XLogP0.38
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(3-methoxy-2-methylpropyl)amino]methyl]cyclobutan-1-ol
CID 116501366
2-[(3-methoxy-2-methylpropyl)amino]cyclobutane-1-carboxylic acid
CID 103245626
N-(3-methoxy-2-methylpropyl)-2,5-dimethylcyclohexan-1-amine
CID 64760108
N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine
CID 103075099
N-(3-methoxy-2-methylpropyl)-2-methylcyclopentan-1-amine
CID 65045798
N-(3-methoxy-2-methylpropyl)-2-propan-2-ylcyclohexan-1-amine
CID 81334166
tert-butyl N-[2-[(3-methoxy-2-methylpropyl)amino]cyclopropyl]carbamate
CID 107238325
2-amino-N-(3-methoxy-2-methylpropyl)cyclopropane-1-carboxamide
CID 114995893
methyl N-(3-methoxy-2-methylpropyl)carbamate
CID 115593989
3-[(3-hydroxycyclobutyl)amino]propane-1,2-diol
CID 77109946
5-chloro-N-(3-methoxy-2-methylpropyl)-2,3-dihydro-1H-inden-2-amine
CID 81332711
N-(3-methoxy-2-methylpropyl)-1-azabicyclo[3.2.1]octan-4-amine
CID 105364526

Frequently Asked Questions

What is the IUPAC name of 3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol?
The IUPAC name of 3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol (CID 116501365) is 3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol.
What is the SMILES notation for 3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol?
The canonical SMILES for 3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol is COCC(C)CNC1CC(O)C1.
What is the InChIKey of 3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol?
The InChIKey is KKFWZFVWCAXDQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-7(6-12-2)5-10-8-3-9(11)4-8/h7-11H,3-6H2,1-2H3.
What are the key properties of 3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol?
3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol has a molecular weight of 173.26 g/mol, XLogP of 0.38, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-methoxy-2-methylpropyl)amino]cyclobutan-1-ol is sourced from PubChem (CID 116501365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).