4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol

C16H28N2O2 — CID 116695217

IUPAC4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol
SMILESCCN(CCOC)CCC(CO)(NC)c1ccccc1
InChIInChI=1S/C16H28N2O2/c1-4-18(12-13-20-3)11-10-16(14-19,17-2)15-8-6-5-7-9-15/h5-9,17,19H,4,10-14H2,1-3H3
InChIKeyIORVCVSZEGYTSY-UHFFFAOYSA-N
MW280.41 g/mol
LogP1.45
Rot. Bonds10

About 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol

4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol (PubChem CID 116695217) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol.

Molecular Properties

Compound Name4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol
PubChem CID116695217
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol
SMILESCCN(CCOC)CCC(CO)(NC)c1ccccc1
InChIInChI=1S/C16H28N2O2/c1-4-18(12-13-20-3)11-10-16(14-19,17-2)15-8-6-5-7-9-15/h5-9,17,19H,4,10-14H2,1-3H3
InChIKeyIORVCVSZEGYTSY-UHFFFAOYSA-N
XLogP1.45
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-methoxyethoxy)-2-(methylamino)-2-phenylbutan-1-ol
CID 116695482
4-[butyl(methyl)amino]-2-(methylamino)-2-phenylbutan-1-ol
CID 116695023
2-amino-4-[bis(2-methoxyethyl)amino]-2-phenylbutan-1-ol
CID 116695232
2-[2-(diethylamino)ethylamino]-3-methoxy-2-phenylpropan-1-ol
CID 103465829
2-(methylamino)-4-[methyl(pentan-2-yl)amino]-2-phenylbutan-1-ol
CID 116695166
3-[1-methoxypropan-2-yl(methyl)amino]-2-(methylamino)-2-phenylpropan-1-ol
CID 64826513
2-(ethylamino)-4-[ethyl(2-methoxyethyl)amino]-2-phenylbutanenitrile
CID 116692501
2-(ethylamino)-4-[3-methoxypropyl(methyl)amino]-2-phenylbutan-1-ol
CID 116694993
4-(3,3-dimethylbutoxy)-2-(methylamino)-2-phenylbutan-1-ol
CID 116695556
4-ethylsulfanyl-2-(methylamino)-2-phenylbutan-1-ol
CID 116695709
4-methoxy-3-(methylamino)-3-phenylbutan-1-ol
CID 103466320
3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
CID 64797612

Frequently Asked Questions

What is the IUPAC name of 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol?
The IUPAC name of 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol (CID 116695217) is 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol.
What is the SMILES notation for 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol?
The canonical SMILES for 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol is CCN(CCOC)CCC(CO)(NC)c1ccccc1.
What is the InChIKey of 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol?
The InChIKey is IORVCVSZEGYTSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-4-18(12-13-20-3)11-10-16(14-19,17-2)15-8-6-5-7-9-15/h5-9,17,19H,4,10-14H2,1-3H3.
What are the key properties of 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol?
4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol has a molecular weight of 280.41 g/mol, XLogP of 1.45, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol is sourced from PubChem (CID 116695217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).