1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol

C12H23NO2 — CID 64812531

IUPAC1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol
SMILESNCC(O)(COC1CCCCC1)C1CC1
InChIInChI=1S/C12H23NO2/c13-8-12(14,10-6-7-10)9-15-11-4-2-1-3-5-11/h10-11,14H,1-9,13H2
InChIKeyDYVDDOXDQYZPAV-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.44
Rot. Bonds5

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

1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol (PubChem CID 64812531) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol.

Molecular Properties

Compound Name1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol
PubChem CID64812531
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol
SMILESNCC(O)(COC1CCCCC1)C1CC1
InChIInChI=1S/C12H23NO2/c13-8-12(14,10-6-7-10)9-15-11-4-2-1-3-5-11/h10-11,14H,1-9,13H2
InChIKeyDYVDDOXDQYZPAV-UHFFFAOYSA-N
XLogP1.44
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.44
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-cyclobutyloxy-2-cyclopropylpropan-2-ol
CID 64819892
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
2-amino-3-cyclohexyloxy-2-cyclopropylpropanamide
CID 63918796
1-amino-2-cyclopropyl-3-hexoxypropan-2-ol
CID 64814184
2-amino-1-cycloheptyl-1-cyclopropylethanol
CID 82928815
2,2,2-trifluoroethoxycycloheptane
CID 148866146
1-amino-2-cyclopropyl-3-[2-(3-methoxypropoxy)ethoxy]propan-2-ol
CID 103181567
1-amino-6-cyclohexyloxy-2-methylhexan-2-ol
CID 64812320
1-amino-3-(3-ethylcyclohexyl)oxy-2-methylpropan-2-ol
CID 64814015
ethoxycyclooctane
CID 13427982

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol?
The IUPAC name of 1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol (CID 64812531) is 1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol.
What is the SMILES notation for 1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol?
The canonical SMILES for 1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol is NCC(O)(COC1CCCCC1)C1CC1.
What is the InChIKey of 1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol?
The InChIKey is DYVDDOXDQYZPAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c13-8-12(14,10-6-7-10)9-15-11-4-2-1-3-5-11/h10-11,14H,1-9,13H2.
What are the key properties of 1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol?
1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol has a molecular weight of 213.32 g/mol, XLogP of 1.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-cyclohexyloxy-2-cyclopropylpropan-2-ol is sourced from PubChem (CID 64812531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).