cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride

C5H13Cl2NO — CID 121471734

IUPACcis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride
SMILESCl.Cl.N[C@H]1CC[C@@H](O)C1
InChIInChI=1S/C5H11NO.2ClH/c6-4-1-2-5(7)3-4;;/h4-5,7H,1-3,6H2;2*1H/t4-,5+;;/m0../s1
InChIKeyKZKNHGZNNQNVGZ-YAQRUTEZSA-N
MW174.07 g/mol
LogP0.70
Rot. Bonds

About cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride

cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride (PubChem CID 121471734) has the molecular formula C5H13Cl2NO and a molecular weight of 174.07 g/mol. Its IUPAC name is cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride.

Molecular Properties

Compound Namecis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride
PubChem CID121471734
Molecular FormulaC5H13Cl2NO
Molecular Weight174.07 g/mol
Exact Mass173.04
IUPAC Namecis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride
SMILESCl.Cl.N[C@H]1CC[C@@H](O)C1
InChIInChI=1S/C5H11NO.2ClH/c6-4-1-2-5(7)3-4;;/h4-5,7H,1-3,6H2;2*1H/t4-,5+;;/m0../s1
InChIKeyKZKNHGZNNQNVGZ-YAQRUTEZSA-N
XLogP0.70
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.07
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1R,3S)-3-aminocyclopentan-1-ol;hydrochloride
CID 56845289
3-aminocyclopentan-1-ol;ethane
CID 144981128
cis-(1S,3R)-3-aminocycloheptan-1-ol;dihydrochloride
CID 175054137
4-amino(1,2,3,4,5,6-13C6)cyclohexan-1-ol
CID 172990620
5-aminocyclohexane-1,3-diol;hydrochloride
CID 172581218
cyclopropanamine;cyclopropanol
CID 67718225
(1R,2S,4R)-4-amino-2-fluorocyclohexan-1-ol;hydrochloride
CID 138629032
(1S,2S,4S)-2,4-diaminocyclohexan-1-ol
CID 55289345
cis-(1S,4R)-4-aminocycloheptan-1-ol
CID 15458399
cyclohexane-1,4-diol;hydrochloride
CID 141062883
cyclohexane-1,4-diamine;hydrochloride
CID 54599176
trans-(1S,3S)-3-(aminomethyl)cyclopentan-1-ol
CID 42614402

Frequently Asked Questions

What is the IUPAC name of cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride?
The IUPAC name of cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride (CID 121471734) is cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride.
What is the SMILES notation for cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride?
The canonical SMILES for cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride is Cl.Cl.N[C@H]1CC[C@@H](O)C1.
What is the InChIKey of cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride?
The InChIKey is KZKNHGZNNQNVGZ-YAQRUTEZSA-N. The full InChI is InChI=1S/C5H11NO.2ClH/c6-4-1-2-5(7)3-4;;/h4-5,7H,1-3,6H2;2*1H/t4-,5+;;/m0../s1.
What are the key properties of cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride?
cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride has a molecular weight of 174.07 g/mol, XLogP of 0.70, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3S)-3-aminocyclopentan-1-ol;dihydrochloride is sourced from PubChem (CID 121471734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).