(1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol

C19H24N2O — CID 15247406

IUPAC(1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol
SMILESO[C@H](c1ccccc1)[C@H](NC1CCCCC1)c1cccnc1
InChIInChI=1S/C19H24N2O/c22-19(15-8-3-1-4-9-15)18(16-10-7-13-20-14-16)21-17-11-5-2-6-12-17/h1,3-4,7-10,13-14,17-19,21-22H,2,5-6,11-12H2/t18-,19-/m1/s1
InChIKeyAHJGPFWDCOWLGA-RTBURBONSA-N
MW296.41 g/mol
LogP3.78
Rot. Bonds5

About (1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol

(1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol (PubChem CID 15247406) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is (1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol.

Molecular Properties

Compound Name(1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol
PubChem CID15247406
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name(1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol
SMILESO[C@H](c1ccccc1)[C@H](NC1CCCCC1)c1cccnc1
InChIInChI=1S/C19H24N2O/c22-19(15-8-3-1-4-9-15)18(16-10-7-13-20-14-16)21-17-11-5-2-6-12-17/h1,3-4,7-10,13-14,17-19,21-22H,2,5-6,11-12H2/t18-,19-/m1/s1
InChIKeyAHJGPFWDCOWLGA-RTBURBONSA-N
XLogP3.78
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-1-pyridin-3-ylethyl]cycloheptanamine
CID 28646604
N-(1-pyridin-3-ylethyl)cyclododecanamine
CID 43079395
(2R)-2-(cyclopentylamino)-2-pyridin-3-ylacetic acid
CID 93412375
(2S)-2-(cyclohexylamino)-1-phenylpropan-1-ol
CID 134503072
(2S)-2-(cycloheptylamino)-1-phenylpropan-1-ol
CID 149151230
(1S,2S)-2-(cyclooctylamino)-1-phenylpropan-1-ol
CID 95510992
3-(cyclohexylamino)-3-oxo-2-pyridin-3-ylpropanoic acid
CID 91593351
2-(cyclohexylamino)-1-phenylbutan-1-ol
CID 82312145
(S)-cyclohexyl(pyridin-3-yl)methanamine
CID 51888927
2-cyclohexyl-1-pyridin-3-ylethanol
CID 22768104
N-[1-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]cyclobutanamine
CID 66962787
(1R,2R)-N'-cyclohexyl-1,2-diphenylethane-1,2-diamine
CID 170788082

Frequently Asked Questions

What is the IUPAC name of (1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol?
The IUPAC name of (1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol (CID 15247406) is (1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol.
What is the SMILES notation for (1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol?
The canonical SMILES for (1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol is O[C@H](c1ccccc1)[C@H](NC1CCCCC1)c1cccnc1.
What is the InChIKey of (1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol?
The InChIKey is AHJGPFWDCOWLGA-RTBURBONSA-N. The full InChI is InChI=1S/C19H24N2O/c22-19(15-8-3-1-4-9-15)18(16-10-7-13-20-14-16)21-17-11-5-2-6-12-17/h1,3-4,7-10,13-14,17-19,21-22H,2,5-6,11-12H2/t18-,19-/m1/s1.
What are the key properties of (1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol?
(1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol has a molecular weight of 296.41 g/mol, XLogP of 3.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-2-(cyclohexylamino)-1-phenyl-2-pyridin-3-ylethanol is sourced from PubChem (CID 15247406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).