1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol

C16H25NO2 — CID 63296177

IUPAC1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol
SMILESCC(C)c1ccc(C(O)CNCC(O)C2CC2)cc1
InChIInChI=1S/C16H25NO2/c1-11(2)12-3-5-13(6-4-12)15(18)9-17-10-16(19)14-7-8-14/h3-6,11,14-19H,7-10H2,1-2H3
InChIKeyJBURPOKGVZIXPC-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.20
Rot. Bonds7

About 1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol

1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol (PubChem CID 63296177) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol
PubChem CID63296177
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol
SMILESCC(C)c1ccc(C(O)CNCC(O)C2CC2)cc1
InChIInChI=1S/C16H25NO2/c1-11(2)12-3-5-13(6-4-12)15(18)9-17-10-16(19)14-7-8-14/h3-6,11,14-19H,7-10H2,1-2H3
InChIKeyJBURPOKGVZIXPC-UHFFFAOYSA-N
XLogP2.20
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-2-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]ethanol
CID 115344990
2-(2,3-dimethylbutylamino)-1-(4-propan-2-ylphenyl)ethanol
CID 64569516
1-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]-4-methylpentan-2-ol
CID 107152724
2-(2-cyclopropylpropylamino)-1-naphthalen-2-ylethanol
CID 115591800
2-(cycloheptylamino)-1-(4-propan-2-ylphenyl)ethanol
CID 60900441
2-(oxan-3-ylmethylamino)-1-(4-propan-2-ylphenyl)ethanol
CID 61019224
1-cyclopropyl-2-[(2-hydroxy-2-thiophen-2-ylethyl)amino]ethanol
CID 63296586
1-cyclopropyl-2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]ethanol
CID 63296627
1-(4-chlorophenyl)-2-(1-cyclopropylethylamino)ethanol
CID 60909738
2-(1-cyclopropylbutan-2-ylamino)-1-(4-propan-2-ylphenyl)ethanol
CID 63995935
2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]propan-1-ol
CID 60909048
2-(2-methylsulfanylethylamino)-1-(4-propan-2-ylphenyl)ethanol
CID 63964232

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol?
The IUPAC name of 1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol (CID 63296177) is 1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol.
What is the SMILES notation for 1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol?
The canonical SMILES for 1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol is CC(C)c1ccc(C(O)CNCC(O)C2CC2)cc1.
What is the InChIKey of 1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol?
The InChIKey is JBURPOKGVZIXPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-11(2)12-3-5-13(6-4-12)15(18)9-17-10-16(19)14-7-8-14/h3-6,11,14-19H,7-10H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol?
1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol has a molecular weight of 263.38 g/mol, XLogP of 2.20, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]ethanol is sourced from PubChem (CID 63296177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).