(3,3-dimethylcyclopentyl)methanamine;hydrochloride

C8H18ClN — CID 22992876

IUPAC(3,3-dimethylcyclopentyl)methanamine;hydrochloride
SMILESCC1(C)CCC(CN)C1.Cl
InChIInChI=1S/C8H17N.ClH/c1-8(2)4-3-7(5-8)6-9;/h7H,3-6,9H2,1-2H3;1H
InChIKeyFBZASIMSKPGYDC-UHFFFAOYSA-N
MW163.69 g/mol
LogP2.19
Rot. Bonds1

About (3,3-dimethylcyclopentyl)methanamine;hydrochloride

(3,3-dimethylcyclopentyl)methanamine;hydrochloride (PubChem CID 22992876) has the molecular formula C8H18ClN and a molecular weight of 163.69 g/mol. Its IUPAC name is (3,3-dimethylcyclopentyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(3,3-dimethylcyclopentyl)methanamine;hydrochloride
PubChem CID22992876
Molecular FormulaC8H18ClN
Molecular Weight163.69 g/mol
Exact Mass163.11
IUPAC Name(3,3-dimethylcyclopentyl)methanamine;hydrochloride
SMILESCC1(C)CCC(CN)C1.Cl
InChIInChI=1S/C8H17N.ClH/c1-8(2)4-3-7(5-8)6-9;/h7H,3-6,9H2,1-2H3;1H
InChIKeyFBZASIMSKPGYDC-UHFFFAOYSA-N
XLogP2.19
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.69
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3,3-dimethylcyclopentyl)methanamine;hydrochloride?
The IUPAC name of (3,3-dimethylcyclopentyl)methanamine;hydrochloride (CID 22992876) is (3,3-dimethylcyclopentyl)methanamine;hydrochloride.
What is the SMILES notation for (3,3-dimethylcyclopentyl)methanamine;hydrochloride?
The canonical SMILES for (3,3-dimethylcyclopentyl)methanamine;hydrochloride is CC1(C)CCC(CN)C1.Cl.
What is the InChIKey of (3,3-dimethylcyclopentyl)methanamine;hydrochloride?
The InChIKey is FBZASIMSKPGYDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.ClH/c1-8(2)4-3-7(5-8)6-9;/h7H,3-6,9H2,1-2H3;1H.
What are the key properties of (3,3-dimethylcyclopentyl)methanamine;hydrochloride?
(3,3-dimethylcyclopentyl)methanamine;hydrochloride has a molecular weight of 163.69 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-dimethylcyclopentyl)methanamine;hydrochloride is sourced from PubChem (CID 22992876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).