N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine

C18H29NO — CID 62108431

IUPACN-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine
SMILESCc1cccc(C(CNC(C)(C)C)OC2CCCC2)c1
InChIInChI=1S/C18H29NO/c1-14-8-7-9-15(12-14)17(13-19-18(2,3)4)20-16-10-5-6-11-16/h7-9,12,16-17,19H,5-6,10-11,13H2,1-4H3
InChIKeyWDTPRMXNYDJWBE-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.38
Rot. Bonds5

About N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine

N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine (PubChem CID 62108431) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine
PubChem CID62108431
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC NameN-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine
SMILESCc1cccc(C(CNC(C)(C)C)OC2CCCC2)c1
InChIInChI=1S/C18H29NO/c1-14-8-7-9-15(12-14)17(13-19-18(2,3)4)20-16-10-5-6-11-16/h7-9,12,16-17,19H,5-6,10-11,13H2,1-4H3
InChIKeyWDTPRMXNYDJWBE-UHFFFAOYSA-N
XLogP4.38
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[2-(3-methylbutoxy)-2-(3-methylphenyl)ethyl]propan-2-amine
CID 63473544
N-[2-cyclohexyloxy-2-(2-fluorophenyl)ethyl]-2-methylpropan-2-amine
CID 62106464
2-(3,4-dimethylcyclohexyl)oxy-N-methyl-2-(3-methylphenyl)ethanamine
CID 64745158
2-cycloheptyloxy-2-(3-fluorophenyl)-N-methylethanamine
CID 62109055
1-cyclopentyloxy-1-(3-methylphenyl)propan-2-amine
CID 55020466
2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine
CID 62383123
1-[1-(4,4-dimethylcyclohexyl)oxy-2-iodoethyl]-3-methylbenzene
CID 114775187
2-(3-methylcyclohexyl)oxy-2-(3-methylphenyl)ethanamine
CID 55020520
(1S)-N-(cyclopentylmethyl)-1-(3-methylphenyl)ethanamine
CID 81364259
2-cyclohexyloxy-N-ethyl-2-(3-methoxyphenyl)ethanamine
CID 62106648
(1R)-N-(cycloheptylmethyl)-1-(3-methylphenyl)ethanamine
CID 81363930
2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine
CID 62383124

Frequently Asked Questions

What is the IUPAC name of N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine?
The IUPAC name of N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine (CID 62108431) is N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine is Cc1cccc(C(CNC(C)(C)C)OC2CCCC2)c1.
What is the InChIKey of N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine?
The InChIKey is WDTPRMXNYDJWBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-14-8-7-9-15(12-14)17(13-19-18(2,3)4)20-16-10-5-6-11-16/h7-9,12,16-17,19H,5-6,10-11,13H2,1-4H3.
What are the key properties of N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine?
N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine has a molecular weight of 275.44 g/mol, XLogP of 4.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62108431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).