3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol

C10H22N2O — CID 130942185

IUPAC3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol
SMILESCCC(CN)C1(O)CCCNC1C
InChIInChI=1S/C10H22N2O/c1-3-9(7-11)10(13)5-4-6-12-8(10)2/h8-9,12-13H,3-7,11H2,1-2H3
InChIKeyCMKZHMYAICBSQS-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.47
Rot. Bonds3

About 3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol

3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol (PubChem CID 130942185) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol.

Molecular Properties

Compound Name3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol
PubChem CID130942185
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol
SMILESCCC(CN)C1(O)CCCNC1C
InChIInChI=1S/C10H22N2O/c1-3-9(7-11)10(13)5-4-6-12-8(10)2/h8-9,12-13H,3-7,11H2,1-2H3
InChIKeyCMKZHMYAICBSQS-UHFFFAOYSA-N
XLogP0.47
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminobutan-2-yl)bicyclo[4.1.0]heptan-2-ol
CID 130526368
1-(1-aminobutan-2-yl)-2-methylsulfonylcyclopentan-1-ol
CID 79123466
1-(1-aminobutan-2-yl)-2,4,4-trimethylcyclohexan-1-ol
CID 81314260
2-(1-aminobutan-2-yl)bicyclo[2.2.2]octan-2-ol
CID 130756587
1-(1-aminopentan-2-yl)-2,3-dimethylcyclohexan-1-ol
CID 79416014
2-methyl-3-propan-2-ylpyrrolidin-3-ol
CID 83815193
4-(1-aminopentan-2-yl)-3-methylpiperidin-4-ol
CID 114502257
2-methyl-1-pentan-3-ylcyclopropan-1-ol
CID 79332194
3-amino-2-methylpiperidine-3-carbonitrile
CID 131218847
4-(1-aminobutan-2-yl)-1-propan-2-ylpiperidin-4-ol
CID 79135293
4-(1-aminopropan-2-yl)-2-methylpiperidin-4-ol
CID 165446656
3-(2,3-dihydrofuran-4-yl)-2-methylpiperidin-3-ol
CID 130914669

Frequently Asked Questions

What is the IUPAC name of 3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol?
The IUPAC name of 3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol (CID 130942185) is 3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol.
What is the SMILES notation for 3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol?
The canonical SMILES for 3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol is CCC(CN)C1(O)CCCNC1C.
What is the InChIKey of 3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol?
The InChIKey is CMKZHMYAICBSQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-3-9(7-11)10(13)5-4-6-12-8(10)2/h8-9,12-13H,3-7,11H2,1-2H3.
What are the key properties of 3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol?
3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol has a molecular weight of 186.30 g/mol, XLogP of 0.47, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-aminobutan-2-yl)-2-methylpiperidin-3-ol is sourced from PubChem (CID 130942185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).