1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol

C20H22N2O — CID 167942481

IUPAC1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol
SMILESCc1ccc(C(O)CN[C@H](C)c2cccc3ccccc23)cn1
InChIInChI=1S/C20H22N2O/c1-14-10-11-17(12-21-14)20(23)13-22-15(2)18-9-5-7-16-6-3-4-8-19(16)18/h3-12,15,20,22-23H,13H2,1-2H3/t15-,20?/m1/s1
InChIKeyIBTPJVXREAXATG-IWPPFLRJSA-N
MW306.41 g/mol
LogP3.93
Rot. Bonds5

About 1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol

1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol (PubChem CID 167942481) has the molecular formula C20H22N2O and a molecular weight of 306.41 g/mol. Its IUPAC name is 1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol.

Molecular Properties

Compound Name1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol
PubChem CID167942481
Molecular FormulaC20H22N2O
Molecular Weight306.41 g/mol
Exact Mass306.17
IUPAC Name1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol
SMILESCc1ccc(C(O)CN[C@H](C)c2cccc3ccccc23)cn1
InChIInChI=1S/C20H22N2O/c1-14-10-11-17(12-21-14)20(23)13-22-15(2)18-9-5-7-16-6-3-4-8-19(16)18/h3-12,15,20,22-23H,13H2,1-2H3/t15-,20?/m1/s1
InChIKeyIBTPJVXREAXATG-IWPPFLRJSA-N
XLogP3.93
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol with MolForge

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Related Compounds

1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol
CID 42942251
3-methyl-1-(1-naphthalen-1-ylethylamino)butan-2-ol
CID 115677077
2-methyl-N-(1-naphthalen-1-ylethyl)butan-1-amine
CID 43094255
2-(benzylamino)-1-(6-methyl-3-pyridinyl)ethanol;dihydrochloride
CID 11587721
3-chloro-N-(1-naphthalen-1-ylethyl)propan-1-amine
CID 175208166
3-[[(1S)-1-naphthalen-1-ylethyl]amino]propan-1-ol
CID 28714573
(2S)-3-amino-1-[[(1R)-1-naphthalen-1-ylethyl]amino]-4-phenylbutan-2-ol
CID 142662293
1-naphthalen-1-yl-N-(pyrimidin-5-ylmethyl)ethanamine
CID 62759136
3-[[(1R)-1-naphthalen-1-ylethyl]amino]-1-[3-(trifluoromethyl)phenyl]propan-1-ol
CID 50993016
N-(1-naphthalen-1-ylethyl)but-3-en-1-amine
CID 115899601
2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol
CID 56694973
2-methyl-5-(1-naphthalen-1-ylethylamino)pentan-1-ol
CID 103905431

Frequently Asked Questions

What is the IUPAC name of 1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol?
The IUPAC name of 1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol (CID 167942481) is 1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol.
What is the SMILES notation for 1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol?
The canonical SMILES for 1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol is Cc1ccc(C(O)CN[C@H](C)c2cccc3ccccc23)cn1.
What is the InChIKey of 1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol?
The InChIKey is IBTPJVXREAXATG-IWPPFLRJSA-N. The full InChI is InChI=1S/C20H22N2O/c1-14-10-11-17(12-21-14)20(23)13-22-15(2)18-9-5-7-16-6-3-4-8-19(16)18/h3-12,15,20,22-23H,13H2,1-2H3/t15-,20?/m1/s1.
What are the key properties of 1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol?
1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol has a molecular weight of 306.41 g/mol, XLogP of 3.93, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol is sourced from PubChem (CID 167942481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).