1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol

C10H19NO2 — CID 64819892

IUPAC1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol
SMILESNCC(O)(COC1CCC1)C1CC1
InChIInChI=1S/C10H19NO2/c11-6-10(12,8-4-5-8)7-13-9-2-1-3-9/h8-9,12H,1-7,11H2
InChIKeyVCJRROGWEXRLOD-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.66
Rot. Bonds5

About 1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol

1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol (PubChem CID 64819892) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol.

Molecular Properties

Compound Name1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol
PubChem CID64819892
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol
SMILESNCC(O)(COC1CCC1)C1CC1
InChIInChI=1S/C10H19NO2/c11-6-10(12,8-4-5-8)7-13-9-2-1-3-9/h8-9,12H,1-7,11H2
InChIKeyVCJRROGWEXRLOD-UHFFFAOYSA-N
XLogP0.66
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-3-cyclopentyloxy-2-cyclopropylpropan-2-ol
CID 64812943
1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol
CID 64812531
1-amino-2-cyclopropyl-3-methoxypropan-2-ol
CID 64813573
1-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 64815024
1-amino-2-cyclopropyl-3-hexoxypropan-2-ol
CID 64814184
1-amino-3-(3-ethylcyclohexyl)oxy-2-methylpropan-2-ol
CID 64814015
1-amino-2-cyclopropyl-3-[2-(3-methoxypropoxy)ethoxy]propan-2-ol
CID 103181567
1-amino-2-cyclopropyl-3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]propan-2-ol
CID 104969021
2-amino-3-cyclohexyloxy-2-cyclopropylpropanamide
CID 63918796
1-amino-2-cyclopropyl-6-methylheptan-2-ol
CID 83158527
1-amino-2-cyclopropyl-3-(oxolan-3-ylmethoxy)propan-2-ol
CID 64819659
3-cyclobutyloxy-2-cyclopropyl-2-(ethylamino)propan-1-ol
CID 64808658

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol?
The IUPAC name of 1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol (CID 64819892) is 1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol.
What is the SMILES notation for 1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol?
The canonical SMILES for 1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol is NCC(O)(COC1CCC1)C1CC1.
What is the InChIKey of 1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol?
The InChIKey is VCJRROGWEXRLOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c11-6-10(12,8-4-5-8)7-13-9-2-1-3-9/h8-9,12H,1-7,11H2.
What are the key properties of 1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol?
1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol has a molecular weight of 185.27 g/mol, XLogP of 0.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol is sourced from PubChem (CID 64819892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).