trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride

C6H14ClNO — CID 134691166

IUPACtrans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride
SMILESCl.NC[C@@H]1CCC[C@@H]1O
InChIInChI=1S/C6H13NO.ClH/c7-4-5-2-1-3-6(5)8;/h5-6,8H,1-4,7H2;1H/t5-,6-;/m0./s1
InChIKeyMYFZRXXEKVDQFB-GEMLJDPKSA-N
MW151.64 g/mol
LogP0.53
Rot. Bonds1

About trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride

trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride (PubChem CID 134691166) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride.

Molecular Properties

Compound Nametrans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride
PubChem CID134691166
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Nametrans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride
SMILESCl.NC[C@@H]1CCC[C@@H]1O
InChIInChI=1S/C6H13NO.ClH/c7-4-5-2-1-3-6(5)8;/h5-6,8H,1-4,7H2;1H/t5-,6-;/m0./s1
InChIKeyMYFZRXXEKVDQFB-GEMLJDPKSA-N
XLogP0.53
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.64
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1S,2S)-2-(aminomethyl)cyclooctan-1-ol;hydrochloride
CID 2725085
2-[2-(aminomethyl)cyclopentyl]oxycyclopentan-1-ol
CID 106940210
cis-(1S,2R)-2-aminocyclopentan-1-ol;hydrochloride
CID 17039404
cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride
CID 171920852
bis(2-aminocyclopentan-1-ol);dihydrochloride
CID 154776416
ethane;2-ethylcyclopentan-1-ol
CID 144624771
cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol
CID 71357650
2-(2-methylbut-2-enyl)cyclopentan-1-ol
CID 67247962
trans-(1R,2R)-2-(aminomethyl)cyclohexan-1-amine;dihydrochloride
CID 163198683
(2-tert-butylcyclopentyl)methanamine
CID 81010669
[2-(aminomethyl)cyclobutyl]methanamine;hydrochloride
CID 175788563
trans-(1S,2S)-2-prop-2-ynylcyclopentan-1-ol
CID 12791810

Frequently Asked Questions

What is the IUPAC name of trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride?
The IUPAC name of trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride (CID 134691166) is trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride.
What is the SMILES notation for trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride?
The canonical SMILES for trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride is Cl.NC[C@@H]1CCC[C@@H]1O.
What is the InChIKey of trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride?
The InChIKey is MYFZRXXEKVDQFB-GEMLJDPKSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c7-4-5-2-1-3-6(5)8;/h5-6,8H,1-4,7H2;1H/t5-,6-;/m0./s1.
What are the key properties of trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride?
trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.53, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride is sourced from PubChem (CID 134691166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).