6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride

C9H18ClNO — CID 153289083

IUPAC6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride
SMILESCC[C@H](N)C1C2CC(O)CC21.Cl
InChIInChI=1S/C9H17NO.ClH/c1-2-8(10)9-6-3-5(11)4-7(6)9;/h5-9,11H,2-4,10H2,1H3;1H/t5?,6?,7?,8-,9?;/m0./s1
InChIKeyAIUQTEUEMMZIOI-HWUUGAPUSA-N
MW191.70 g/mol
LogP1.16
Rot. Bonds2

About 6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride

6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride (PubChem CID 153289083) has the molecular formula C9H18ClNO and a molecular weight of 191.70 g/mol. Its IUPAC name is 6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride.

Molecular Properties

Compound Name6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride
PubChem CID153289083
Molecular FormulaC9H18ClNO
Molecular Weight191.70 g/mol
Exact Mass191.11
IUPAC Name6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride
SMILESCC[C@H](N)C1C2CC(O)CC21.Cl
InChIInChI=1S/C9H17NO.ClH/c1-2-8(10)9-6-3-5(11)4-7(6)9;/h5-9,11H,2-4,10H2,1H3;1H/t5?,6?,7?,8-,9?;/m0./s1
InChIKeyAIUQTEUEMMZIOI-HWUUGAPUSA-N
XLogP1.16
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.70
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1-aminopropyl)cyclohexan-1-ol
CID 116941798
(1S,2S,3S,5R)-2-(1-amino-2-ethylbutyl)-3,5-dimethylcyclopentan-1-ol
CID 59063057
cyclohexane-1,3,5-triol;ethanol
CID 143582059
3-(1-amino-2-hydroxyethyl)cyclobutan-1-ol
CID 139688623
4-(1-aminopropyl)oxolan-3-ol
CID 55288646
1-(3-ethylcyclobutyl)propan-1-amine
CID 144526392
1-aminopropan-1-ol;hydrochloride
CID 18547293
cis-(1R,2S)-cyclopentane-1,2,4-triol
CID 11073392
(1S)-1-(2,2-dimethylcyclopropyl)propan-1-amine
CID 107924727
8-(3-amino-1,1,1-trifluoropentan-2-yl)-8-azabicyclo[3.2.1]octan-3-ol
CID 63763233
1-(3-ethylcyclopentyl)propan-1-amine
CID 65410017
cyclohexane-1,4-diol;2-methylbutane
CID 145319923

Frequently Asked Questions

What is the IUPAC name of 6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride?
The IUPAC name of 6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride (CID 153289083) is 6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride.
What is the SMILES notation for 6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride?
The canonical SMILES for 6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride is CC[C@H](N)C1C2CC(O)CC21.Cl.
What is the InChIKey of 6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride?
The InChIKey is AIUQTEUEMMZIOI-HWUUGAPUSA-N. The full InChI is InChI=1S/C9H17NO.ClH/c1-2-8(10)9-6-3-5(11)4-7(6)9;/h5-9,11H,2-4,10H2,1H3;1H/t5?,6?,7?,8-,9?;/m0./s1.
What are the key properties of 6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride?
6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride has a molecular weight of 191.70 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1S)-1-aminopropyl]bicyclo[3.1.0]hexan-3-ol;hydrochloride is sourced from PubChem (CID 153289083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).