2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride

C20H33ClN2O2 — CID 120916282

IUPAC2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride
SMILESCC(C)c1ccccc1OCCNC1CCCC1C1COCCN1.Cl
InChIInChI=1S/C20H32N2O2.ClH/c1-15(2)16-6-3-4-9-20(16)24-13-11-21-18-8-5-7-17(18)19-14-23-12-10-22-19;/h3-4,6,9,15,17-19,21-22H,5,7-8,10-14H2,1-2H3;1H
InChIKeyCBOCMVCKSPTFOJ-UHFFFAOYSA-N
MW368.95 g/mol
LogP3.36
Rot. Bonds7

About 2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride

2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride (PubChem CID 120916282) has the molecular formula C20H33ClN2O2 and a molecular weight of 368.95 g/mol. Its IUPAC name is 2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride.

Molecular Properties

Compound Name2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride
PubChem CID120916282
Molecular FormulaC20H33ClN2O2
Molecular Weight368.95 g/mol
Exact Mass368.22
IUPAC Name2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride
SMILESCC(C)c1ccccc1OCCNC1CCCC1C1COCCN1.Cl
InChIInChI=1S/C20H32N2O2.ClH/c1-15(2)16-6-3-4-9-20(16)24-13-11-21-18-8-5-7-17(18)19-14-23-12-10-22-19;/h3-4,6,9,15,17-19,21-22H,5,7-8,10-14H2,1-2H3;1H
InChIKeyCBOCMVCKSPTFOJ-UHFFFAOYSA-N
XLogP3.36
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.95
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-fluorophenoxy)ethyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120913887
N-[2-(3-chlorophenoxy)ethyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120914256
1-(2-methoxyphenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]ethanol;hydrochloride
CID 120914206
N-[2-(2-methoxyphenyl)ethyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120914428
N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120916118
N-[2-(3-tert-butylphenoxy)ethyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120916338
2-morpholin-3-yl-N-[(2-propan-2-yloxyphenyl)methyl]cyclopentan-1-amine
CID 120914019
N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120914402
N-[2-(2-methoxyphenoxy)propyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120914873
N-[2-(3-fluorophenoxy)ethyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120914249
2-morpholin-3-yl-N-(2-phenylsulfanylethyl)cyclopentan-1-amine
CID 120914703
2-morpholin-3-yl-N-[2-[3-(trifluoromethyl)phenoxy]ethyl]cyclopentan-1-amine
CID 120914273

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride?
The IUPAC name of 2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride (CID 120916282) is 2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride.
What is the SMILES notation for 2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride?
The canonical SMILES for 2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride is CC(C)c1ccccc1OCCNC1CCCC1C1COCCN1.Cl.
What is the InChIKey of 2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride?
The InChIKey is CBOCMVCKSPTFOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O2.ClH/c1-15(2)16-6-3-4-9-20(16)24-13-11-21-18-8-5-7-17(18)19-14-23-12-10-22-19;/h3-4,6,9,15,17-19,21-22H,5,7-8,10-14H2,1-2H3;1H.
What are the key properties of 2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride?
2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride has a molecular weight of 368.95 g/mol, XLogP of 3.36, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-3-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]cyclopentan-1-amine;hydrochloride is sourced from PubChem (CID 120916282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).