N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride

C9H20ClN — CID 154577104

IUPACN-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride
SMILESCCNC1CCCC1(C)C.Cl
InChIInChI=1S/C9H19N.ClH/c1-4-10-8-6-5-7-9(8,2)3;/h8,10H,4-7H2,1-3H3;1H
InChIKeyJLIFZCLITAXQJU-UHFFFAOYSA-N
MW177.72 g/mol
LogP2.60
Rot. Bonds2

About N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride

N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride (PubChem CID 154577104) has the molecular formula C9H20ClN and a molecular weight of 177.72 g/mol. Its IUPAC name is N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride.

Molecular Properties

Compound NameN-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride
PubChem CID154577104
Molecular FormulaC9H20ClN
Molecular Weight177.72 g/mol
Exact Mass177.13
IUPAC NameN-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride
SMILESCCNC1CCCC1(C)C.Cl
InChIInChI=1S/C9H19N.ClH/c1-4-10-8-6-5-7-9(8,2)3;/h8,10H,4-7H2,1-3H3;1H
InChIKeyJLIFZCLITAXQJU-UHFFFAOYSA-N
XLogP2.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.72
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride?
The IUPAC name of N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride (CID 154577104) is N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride.
What is the SMILES notation for N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride?
The canonical SMILES for N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride is CCNC1CCCC1(C)C.Cl.
What is the InChIKey of N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride?
The InChIKey is JLIFZCLITAXQJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.ClH/c1-4-10-8-6-5-7-9(8,2)3;/h8,10H,4-7H2,1-3H3;1H.
What are the key properties of N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride?
N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride has a molecular weight of 177.72 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride is sourced from PubChem (CID 154577104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).