2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol

C18H32N2O — CID 62258274

IUPAC2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol
SMILESCCN(CCO)CC(C)(CNCC(C)C)c1ccccc1
InChIInChI=1S/C18H32N2O/c1-5-20(11-12-21)15-18(4,14-19-13-16(2)3)17-9-7-6-8-10-17/h6-10,16,19,21H,5,11-15H2,1-4H3
InChIKeyWVRDVDOZCORJKG-UHFFFAOYSA-N
MW292.47 g/mol
LogP2.50
Rot. Bonds10

About 2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol

2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol (PubChem CID 62258274) has the molecular formula C18H32N2O and a molecular weight of 292.47 g/mol. Its IUPAC name is 2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol.

Molecular Properties

Compound Name2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol
PubChem CID62258274
Molecular FormulaC18H32N2O
Molecular Weight292.47 g/mol
Exact Mass292.25
IUPAC Name2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol
SMILESCCN(CCO)CC(C)(CNCC(C)C)c1ccccc1
InChIInChI=1S/C18H32N2O/c1-5-20(11-12-21)15-18(4,14-19-13-16(2)3)17-9-7-6-8-10-17/h6-10,16,19,21H,5,11-15H2,1-4H3
InChIKeyWVRDVDOZCORJKG-UHFFFAOYSA-N
XLogP2.50
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[ethyl-[2-methyl-2-phenyl-3-(propan-2-ylamino)propyl]amino]ethanol
CID 62258100
N,N'-diethyl-2-methyl-2-phenyl-N'-propylpropane-1,3-diamine
CID 62262898
1-[ethyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]-2-methylpropan-2-ol
CID 79377198
2-methyl-2-phenyl-N,N,N'-tripropylpropane-1,3-diamine
CID 63482320
N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine
CID 62261442
2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol
CID 102871059
N-benzyl-N,2-diethyl-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine
CID 63482890
2-[[2-ethyl-2-[(2-methylpropylamino)methyl]butyl]-(2-hydroxyethyl)amino]ethanol
CID 55056371
2-ethyl-N-(2-methylpropyl)-2-phenylbutan-1-amine
CID 62594549
N-ethyl-2,2-dimethyl-N'-(2-methylpropyl)-N-phenylpropane-1,3-diamine
CID 55195781
N-(cyclopropylmethyl)-N-ethyl-2-methyl-2-phenyl-N'-propylpropane-1,3-diamine
CID 63954461
N-butan-2-yl-N,2-dimethyl-2-phenyl-N'-propylpropane-1,3-diamine
CID 62263083

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol?
The IUPAC name of 2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol (CID 62258274) is 2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol.
What is the SMILES notation for 2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol?
The canonical SMILES for 2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol is CCN(CCO)CC(C)(CNCC(C)C)c1ccccc1.
What is the InChIKey of 2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol?
The InChIKey is WVRDVDOZCORJKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O/c1-5-20(11-12-21)15-18(4,14-19-13-16(2)3)17-9-7-6-8-10-17/h6-10,16,19,21H,5,11-15H2,1-4H3.
What are the key properties of 2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol?
2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol has a molecular weight of 292.47 g/mol, XLogP of 2.50, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol is sourced from PubChem (CID 62258274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).