N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride

C19H24ClNO2 — CID 18969696

IUPACN-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride
SMILESCNC1CCCC1Oc1ccc(OCc2ccccc2)cc1.Cl
InChIInChI=1S/C19H23NO2.ClH/c1-20-18-8-5-9-19(18)22-17-12-10-16(11-13-17)21-14-15-6-3-2-4-7-15;/h2-4,6-7,10-13,18-20H,5,8-9,14H2,1H3;1H
InChIKeyZKDARHSBEJGEAD-UHFFFAOYSA-N
MW333.86 g/mol
LogP4.21
Rot. Bonds6

About N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride

N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride (PubChem CID 18969696) has the molecular formula C19H24ClNO2 and a molecular weight of 333.86 g/mol. Its IUPAC name is N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride.

Molecular Properties

Compound NameN-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride
PubChem CID18969696
Molecular FormulaC19H24ClNO2
Molecular Weight333.86 g/mol
Exact Mass333.15
IUPAC NameN-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride
SMILESCNC1CCCC1Oc1ccc(OCc2ccccc2)cc1.Cl
InChIInChI=1S/C19H23NO2.ClH/c1-20-18-8-5-9-19(18)22-17-12-10-16(11-13-17)21-14-15-6-3-2-4-7-15;/h2-4,6-7,10-13,18-20H,5,8-9,14H2,1H3;1H
InChIKeyZKDARHSBEJGEAD-UHFFFAOYSA-N
XLogP4.21
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.86
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1S,2S)-N-methyl-2-[(4-phenylmethoxyphenyl)methyl]cyclopentan-1-amine
CID 67573261
trans-(1R,2R)-N-methyl-2-phenylmethoxycyclopentan-1-amine
CID 58216107
N-methyl-2-(4-propylphenoxy)cyclopentan-1-amine
CID 55085230
N-methyl-1-(4-phenylmethoxyphenoxy)-2,3-dihydro-1H-inden-2-amine
CID 19075628
trans-(1R,2R)-N-methyl-2-(4-methylphenoxy)cyclohexan-1-amine;hydrochloride
CID 24837203
cis-(1S,2R)-2-[(6-iodo-3-pyridinyl)oxy]-N-methylcyclopentan-1-amine
CID 134601508
4-[2-(methylamino)cyclohexyl]oxybenzonitrile
CID 102634794
N-methyl-4-phenylmethoxyaniline;hydrochloride
CID 75481675
2-(4-benzylphenoxy)cyclopentan-1-amine
CID 62274386
1-(cyclobutylmethoxymethyl)-4-phenylmethoxybenzene
CID 125465491
(3R,4R)-1-methyl-3-phenyl-4-(4-phenylmethoxyphenoxy)piperidine;hydrochloride
CID 70531581
2-(4-phenylmethoxyphenoxy)oxane
CID 11076959

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride?
The IUPAC name of N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride (CID 18969696) is N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride.
What is the SMILES notation for N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride?
The canonical SMILES for N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride is CNC1CCCC1Oc1ccc(OCc2ccccc2)cc1.Cl.
What is the InChIKey of N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride?
The InChIKey is ZKDARHSBEJGEAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2.ClH/c1-20-18-8-5-9-19(18)22-17-12-10-16(11-13-17)21-14-15-6-3-2-4-7-15;/h2-4,6-7,10-13,18-20H,5,8-9,14H2,1H3;1H.
What are the key properties of N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride?
N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride has a molecular weight of 333.86 g/mol, XLogP of 4.21, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-phenylmethoxyphenoxy)cyclopentan-1-amine;hydrochloride is sourced from PubChem (CID 18969696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).