5-amino-2-cyclobutyl-1-methoxypentan-2-ol

C10H21NO2 — CID 103391375

IUPAC5-amino-2-cyclobutyl-1-methoxypentan-2-ol
SMILESCOCC(O)(CCCN)C1CCC1
InChIInChI=1S/C10H21NO2/c1-13-8-10(12,6-3-7-11)9-4-2-5-9/h9,12H,2-8,11H2,1H3
InChIKeyVNLUNXNDZHKOQV-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.90
Rot. Bonds6

About 5-amino-2-cyclobutyl-1-methoxypentan-2-ol

5-amino-2-cyclobutyl-1-methoxypentan-2-ol (PubChem CID 103391375) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 5-amino-2-cyclobutyl-1-methoxypentan-2-ol.

Molecular Properties

Compound Name5-amino-2-cyclobutyl-1-methoxypentan-2-ol
PubChem CID103391375
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name5-amino-2-cyclobutyl-1-methoxypentan-2-ol
SMILESCOCC(O)(CCCN)C1CCC1
InChIInChI=1S/C10H21NO2/c1-13-8-10(12,6-3-7-11)9-4-2-5-9/h9,12H,2-8,11H2,1H3
InChIKeyVNLUNXNDZHKOQV-UHFFFAOYSA-N
XLogP0.90
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-2-cyclopropyl-3-methoxypropan-2-ol
CID 64813573
5-amino-2-cyclobutylpentan-2-ol
CID 130580664
5-amino-1-methoxy-2-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)pentan-2-ol
CID 103391340
4-cyclopropyl-4-fluoro-5-methoxypentan-1-amine
CID 103392479
3-cyclobutyl-3-methoxybutan-1-amine
CID 105430822
(1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane
CID 89106500
(2R)-1-amino-2-cyclopentylpropan-2-ol
CID 94524784
1-amino-2-cyclopropyl-3-[2-(3-methoxypropoxy)ethoxy]propan-2-ol
CID 103181567
(2S)-1-amino-2-cyclohexylpropan-2-ol
CID 93298138
1-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 64815024
4-(4-ethylcyclohexyl)-4-fluoro-5-methoxypentan-1-amine
CID 103392599
2-cyclohexyl-2-(methoxymethyl)pentan-1-amine
CID 139927573

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-cyclobutyl-1-methoxypentan-2-ol?
The IUPAC name of 5-amino-2-cyclobutyl-1-methoxypentan-2-ol (CID 103391375) is 5-amino-2-cyclobutyl-1-methoxypentan-2-ol.
What is the SMILES notation for 5-amino-2-cyclobutyl-1-methoxypentan-2-ol?
The canonical SMILES for 5-amino-2-cyclobutyl-1-methoxypentan-2-ol is COCC(O)(CCCN)C1CCC1.
What is the InChIKey of 5-amino-2-cyclobutyl-1-methoxypentan-2-ol?
The InChIKey is VNLUNXNDZHKOQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-13-8-10(12,6-3-7-11)9-4-2-5-9/h9,12H,2-8,11H2,1H3.
What are the key properties of 5-amino-2-cyclobutyl-1-methoxypentan-2-ol?
5-amino-2-cyclobutyl-1-methoxypentan-2-ol has a molecular weight of 187.28 g/mol, XLogP of 0.90, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-cyclobutyl-1-methoxypentan-2-ol is sourced from PubChem (CID 103391375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).