2-cyclopentyl-N-ethylethanamine;hydrochloride

C9H20ClN — CID 3028141

IUPAC2-cyclopentyl-N-ethylethanamine;hydrochloride
SMILESCCNCCC1CCCC1.Cl
InChIInChI=1S/C9H19N.ClH/c1-2-10-8-7-9-5-3-4-6-9;/h9-10H,2-8H2,1H3;1H
InChIKeyBMKWAHAGEBHEDZ-UHFFFAOYSA-N
MW177.72 g/mol
LogP2.60
Rot. Bonds4

About 2-cyclopentyl-N-ethylethanamine;hydrochloride

2-cyclopentyl-N-ethylethanamine;hydrochloride (PubChem CID 3028141) has the molecular formula C9H20ClN and a molecular weight of 177.72 g/mol. Its IUPAC name is 2-cyclopentyl-N-ethylethanamine;hydrochloride.

Molecular Properties

Compound Name2-cyclopentyl-N-ethylethanamine;hydrochloride
PubChem CID3028141
Molecular FormulaC9H20ClN
Molecular Weight177.72 g/mol
Exact Mass177.13
IUPAC Name2-cyclopentyl-N-ethylethanamine;hydrochloride
SMILESCCNCCC1CCCC1.Cl
InChIInChI=1S/C9H19N.ClH/c1-2-10-8-7-9-5-3-4-6-9;/h9-10H,2-8H2,1H3;1H
InChIKeyBMKWAHAGEBHEDZ-UHFFFAOYSA-N
XLogP2.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(4-bicyclo[6.2.0]decanyl)-N-ethylethanamine
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N-(2-cyclohexylethyl)butan-1-amine;hydrochloride
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N-ethyl-2-[(3S)-piperidin-3-yl]ethanamine
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N-ethyl-2-(oxan-3-yl)ethanamine
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ethane;N-ethyl-2-[(1S)-3-methylcyclohexyl]ethanamine
CID 145095472
2-(2-cyclopentylethylamino)ethanol;hydrochloride
CID 22723115
N-ethyl-2-[4-(methoxymethyl)cyclohexyl]ethanamine
CID 163663067
N-(2-cyclopentylethyl)-2-ethylbutan-1-amine
CID 60732890
N-(chloromethyl)-2-cyclopentylethanamine
CID 115263432
2-cyclononyl-N-(cyclononylmethyl)ethanamine
CID 91347612
2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine;hydrochloride
CID 22723059
4-cyclopentyl-N-[2-(ethylamino)ethyl]butanamide;hydrochloride
CID 119509622

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-ethylethanamine;hydrochloride?
The IUPAC name of 2-cyclopentyl-N-ethylethanamine;hydrochloride (CID 3028141) is 2-cyclopentyl-N-ethylethanamine;hydrochloride.
What is the SMILES notation for 2-cyclopentyl-N-ethylethanamine;hydrochloride?
The canonical SMILES for 2-cyclopentyl-N-ethylethanamine;hydrochloride is CCNCCC1CCCC1.Cl.
What is the InChIKey of 2-cyclopentyl-N-ethylethanamine;hydrochloride?
The InChIKey is BMKWAHAGEBHEDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.ClH/c1-2-10-8-7-9-5-3-4-6-9;/h9-10H,2-8H2,1H3;1H.
What are the key properties of 2-cyclopentyl-N-ethylethanamine;hydrochloride?
2-cyclopentyl-N-ethylethanamine;hydrochloride has a molecular weight of 177.72 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-ethylethanamine;hydrochloride is sourced from PubChem (CID 3028141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).