1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol

C19H21N3O2 — CID 133470787

IUPAC1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol
SMILESCC(C)Oc1nccnc1NCC(O)c1ccc2ccccc2c1
InChIInChI=1S/C19H21N3O2/c1-13(2)24-19-18(20-9-10-21-19)22-12-17(23)16-8-7-14-5-3-4-6-15(14)11-16/h3-11,13,17,23H,12H2,1-2H3,(H,20,22)
InChIKeyHTQMSQZXYGEHAI-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.56
Rot. Bonds6

About 1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol

1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol (PubChem CID 133470787) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol.

Molecular Properties

Compound Name1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol
PubChem CID133470787
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol
SMILESCC(C)Oc1nccnc1NCC(O)c1ccc2ccccc2c1
InChIInChI=1S/C19H21N3O2/c1-13(2)24-19-18(20-9-10-21-19)22-12-17(23)16-8-7-14-5-3-4-6-15(14)11-16/h3-11,13,17,23H,12H2,1-2H3,(H,20,22)
InChIKeyHTQMSQZXYGEHAI-UHFFFAOYSA-N
XLogP3.56
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-fluorophenyl)-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol
CID 133468845
N-(2-methoxy-2-phenylethyl)-3-propan-2-yloxypyrazin-2-amine
CID 133442641
1-cyclopropyl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol
CID 133443246
N-(2-hydroxy-2-naphthalen-2-ylethyl)-2-methylpropanamide
CID 111112159
(1R)-2-[[(2S)-3,3-dimethylbutan-2-yl]amino]-1-naphthalen-2-ylethanol
CID 124562243
2-(2,2-dimethylpropylamino)-1-naphthalen-2-ylethanol
CID 61167220
2-(2-cyclopropylpropylamino)-1-naphthalen-2-ylethanol
CID 115591800
2-(3-methylanilino)-1-naphthalen-2-ylethanol
CID 60903235
2-(2,2-dimethylhydrazinyl)-1-naphthalen-2-ylethanol
CID 83014779
2-[[(2S)-2-hydroxy-2-naphthalen-2-ylethyl]amino]-2-methylpropane-1,3-diol
CID 124571352
2-[(2-hydroxy-2-naphthalen-2-ylethyl)amino]-N-methylpropanamide
CID 61464613
2-[(4-methylpyrimidin-2-yl)amino]-1-(3-propan-2-yloxyphenyl)ethanol
CID 133304652

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol?
The IUPAC name of 1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol (CID 133470787) is 1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol.
What is the SMILES notation for 1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol?
The canonical SMILES for 1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol is CC(C)Oc1nccnc1NCC(O)c1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol?
The InChIKey is HTQMSQZXYGEHAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-13(2)24-19-18(20-9-10-21-19)22-12-17(23)16-8-7-14-5-3-4-6-15(14)11-16/h3-11,13,17,23H,12H2,1-2H3,(H,20,22).
What are the key properties of 1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol?
1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol has a molecular weight of 323.40 g/mol, XLogP of 3.56, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-2-[(3-propan-2-yloxypyrazin-2-yl)amino]ethanol is sourced from PubChem (CID 133470787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).