2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol

C18H30N2O — CID 102871059

IUPAC2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol
SMILESCCNCC(C)(CN(CCO)C1CCC1)c1ccccc1
InChIInChI=1S/C18H30N2O/c1-3-19-14-18(2,16-8-5-4-6-9-16)15-20(12-13-21)17-10-7-11-17/h4-6,8-9,17,19,21H,3,7,10-15H2,1-2H3
InChIKeyLIXSAIAAAYUFMX-UHFFFAOYSA-N
MW290.45 g/mol
LogP2.40
Rot. Bonds9

About 2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol

2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol (PubChem CID 102871059) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol
PubChem CID102871059
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol
SMILESCCNCC(C)(CN(CCO)C1CCC1)c1ccccc1
InChIInChI=1S/C18H30N2O/c1-3-19-14-18(2,16-8-5-4-6-9-16)15-20(12-13-21)17-10-7-11-17/h4-6,8-9,17,19,21H,3,7,10-15H2,1-2H3
InChIKeyLIXSAIAAAYUFMX-UHFFFAOYSA-N
XLogP2.40
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclopropyl-[2-methyl-3-(methylamino)-2-phenylpropyl]amino]ethanol
CID 55056120
N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine
CID 62261792
2-[cyclopentyl-[3-(ethylamino)-2,2-dimethylpropyl]amino]ethanol
CID 62261165
2-[cyclobutyl-[2-(ethylaminomethyl)-2-methylbutyl]amino]ethanol
CID 102870942
1-[cyclopropyl(2-hydroxyethyl)amino]-2-phenylpropan-2-ol
CID 62373661
N-(cyclopentylmethyl)-N'-ethyl-N,2-dimethyl-2-phenylpropane-1,3-diamine
CID 63631647
1-[ethyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]-2-methylpropan-2-ol
CID 79377198
N,N'-diethyl-2-methyl-2-phenyl-N'-propylpropane-1,3-diamine
CID 62262898
N-cyclopropyl-N',2-dimethyl-N-(3-methylbutyl)-2-phenylpropane-1,3-diamine
CID 78987346
[1-[3-(ethylamino)-2-methyl-2-phenylpropyl]pyrrolidin-2-yl]methanol
CID 62259805
N-ethyl-N',2-dimethyl-2-phenyl-N'-(2,2,2-trifluoroethyl)propane-1,3-diamine
CID 62256339
N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine
CID 62261442

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol?
The IUPAC name of 2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol (CID 102871059) is 2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol.
What is the SMILES notation for 2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol?
The canonical SMILES for 2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol is CCNCC(C)(CN(CCO)C1CCC1)c1ccccc1.
What is the InChIKey of 2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol?
The InChIKey is LIXSAIAAAYUFMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-3-19-14-18(2,16-8-5-4-6-9-16)15-20(12-13-21)17-10-7-11-17/h4-6,8-9,17,19,21H,3,7,10-15H2,1-2H3.
What are the key properties of 2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol?
2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol has a molecular weight of 290.45 g/mol, XLogP of 2.40, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol is sourced from PubChem (CID 102871059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).