(3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol

C8H18N2O — CID 124547059

IUPAC(3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol
SMILESC[C@H](N)CN1CCC[C@H](O)C1
InChIInChI=1S/C8H18N2O/c1-7(9)5-10-4-2-3-8(11)6-10/h7-8,11H,2-6,9H2,1H3/t7-,8-/m0/s1
InChIKeyFOHWCNYIABKWSM-YUMQZZPRSA-N
MW158.25 g/mol
LogP-0.21
Rot. Bonds2

About (3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol

(3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol (PubChem CID 124547059) has the molecular formula C8H18N2O and a molecular weight of 158.25 g/mol. Its IUPAC name is (3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol.

Molecular Properties

Compound Name(3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol
PubChem CID124547059
Molecular FormulaC8H18N2O
Molecular Weight158.25 g/mol
Exact Mass158.14
IUPAC Name(3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol
SMILESC[C@H](N)CN1CCC[C@H](O)C1
InChIInChI=1S/C8H18N2O/c1-7(9)5-10-4-2-3-8(11)6-10/h7-8,11H,2-6,9H2,1H3/t7-,8-/m0/s1
InChIKeyFOHWCNYIABKWSM-YUMQZZPRSA-N
XLogP-0.21
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.25
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-(2-methylpropyl)azepan-3-ol
CID 171752832
3-(3-hydroxypiperidin-1-yl)-2-methylpropanenitrile
CID 60649366
(2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine
CID 103934495
1-[(2R)-2-aminopropyl]piperidin-4-ol
CID 130939157
(2R)-1-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)propan-2-amine
CID 103934627
(2R)-1-(3-methylsulfanylpiperidin-1-yl)propan-2-amine
CID 127004218
1-(chloromethyl)piperidin-3-ol
CID 53403087
methyl 2-bromo-3-(3-hydroxypiperidin-1-yl)propanoate
CID 81100552
(2R)-1-(3-methylsulfonylpiperidin-1-yl)propan-2-amine
CID 130715172
(3S)-1-(2-hydroxy-3-methoxypropyl)piperidin-3-ol
CID 107226168
1-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-2-amine
CID 83835140
(2S)-1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)propan-2-amine
CID 103934754

Frequently Asked Questions

What is the IUPAC name of (3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol?
The IUPAC name of (3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol (CID 124547059) is (3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol.
What is the SMILES notation for (3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol?
The canonical SMILES for (3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol is C[C@H](N)CN1CCC[C@H](O)C1.
What is the InChIKey of (3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol?
The InChIKey is FOHWCNYIABKWSM-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H18N2O/c1-7(9)5-10-4-2-3-8(11)6-10/h7-8,11H,2-6,9H2,1H3/t7-,8-/m0/s1.
What are the key properties of (3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol?
(3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol has a molecular weight of 158.25 g/mol, XLogP of -0.21, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol is sourced from PubChem (CID 124547059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).