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

C10H19NO2 — CID 114358245

IUPAC3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol
SMILESNC(C1CC1)C(CO)OC1CCC1
InChIInChI=1S/C10H19NO2/c11-10(7-4-5-7)9(6-12)13-8-2-1-3-8/h7-10,12H,1-6,11H2
InChIKeyJMEQXTAYUKKORE-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.65
Rot. Bonds5

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

3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol (PubChem CID 114358245) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol.

Molecular Properties

Compound Name3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol
PubChem CID114358245
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol
SMILESNC(C1CC1)C(CO)OC1CCC1
InChIInChI=1S/C10H19NO2/c11-10(7-4-5-7)9(6-12)13-8-2-1-3-8/h7-10,12H,1-6,11H2
InChIKeyJMEQXTAYUKKORE-UHFFFAOYSA-N
XLogP0.65
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 ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-Amino-3-cyclopropylpropane-1,2-diol
CID 131472467
3-Amino-3-cyclopropyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)propan-1-ol
CID 102721916
3-Amino-3-cyclopropyl-2-(2,2,3,3,3-pentafluoropropoxy)propan-1-ol
CID 113574186
3-Amino-3-cyclopropyl-2-(2,2,2-trifluoroethoxy)propan-1-ol
CID 114357804
3-Amino-3-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-ol
CID 114358136
3-Amino-3-cyclopropyl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-ol
CID 114358326
3-Amino-3-cyclopropyl-2-(2,2-difluoroethoxy)propan-1-ol
CID 114358360
3-Amino-3-cyclopropyl-2-(4,4,4-trifluorobutoxy)propan-1-ol
CID 114358366
3-Amino-3-cyclopropyl-2-(3,3,3-trifluoropropoxy)propan-1-ol
CID 114358371
(2RS, 3S)-3-amino-2-hydroxy-5-methylhexyl isoamyl ether
CID 86743184
(2RS, 3S)-3-amino-2-hydroxy-5-methylhexyl isoamyl ether hydrochloride
CID 131715983
3-Amino-1-methoxy-5-methylhexan-2-ol
CID 13909436

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol?
The IUPAC name of 3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol (CID 114358245) is 3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol.
What is the SMILES notation for 3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol?
The canonical SMILES for 3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol is NC(C1CC1)C(CO)OC1CCC1.
What is the InChIKey of 3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol?
The InChIKey is JMEQXTAYUKKORE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c11-10(7-4-5-7)9(6-12)13-8-2-1-3-8/h7-10,12H,1-6,11H2.
What are the key properties of 3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol?
3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol has a molecular weight of 185.27 g/mol, XLogP of 0.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-cyclobutyloxy-3-cyclopropylpropan-1-ol is sourced from PubChem (CID 114358245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).