(1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol

C18H19N3O2 — CID 97209953

IUPAC(1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol
SMILESC[C@@H](O)c1cccc(N(C)Cc2cc(-c3ccccc3)no2)n1
InChIInChI=1S/C18H19N3O2/c1-13(22)16-9-6-10-18(19-16)21(2)12-15-11-17(20-23-15)14-7-4-3-5-8-14/h3-11,13,22H,12H2,1-2H3/t13-/m1/s1
InChIKeyMDGCUKKHBPDZLC-CYBMUJFWSA-N
MW309.37 g/mol
LogP3.43
Rot. Bonds5

About (1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol

(1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol (PubChem CID 97209953) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is (1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol
PubChem CID97209953
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name(1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol
SMILESC[C@@H](O)c1cccc(N(C)Cc2cc(-c3ccccc3)no2)n1
InChIInChI=1S/C18H19N3O2/c1-13(22)16-9-6-10-18(19-16)21(2)12-15-11-17(20-23-15)14-7-4-3-5-8-14/h3-11,13,22H,12H2,1-2H3/t13-/m1/s1
InChIKeyMDGCUKKHBPDZLC-CYBMUJFWSA-N
XLogP3.43
TPSA62.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol with MolForge

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Related Compounds

N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine
CID 15761396
(2R)-3-[methyl-[2-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]amino]propane-1,2-diol
CID 98841948
N'-methyl-N'-[(3-phenyl-1,2-oxazol-5-yl)methyl]ethane-1,2-diamine
CID 62686446
2-[2-methylpropyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetic acid
CID 63065042
2-[2-hydroxyethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol
CID 62021320
1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol
CID 72918772
N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-thiophen-3-ylmethanamine
CID 56888188
N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]butane-1-sulfonamide
CID 71996846
(2S)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)-N,2-dimethyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide
CID 95861634
N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,1,3-benzoxadiazole-5-carboxamide
CID 70786939
2-[(3-phenyl-1,2-oxazol-5-yl)methyl-propylamino]acetic acid
CID 61006913
N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-pyrazin-2-ylpropan-2-amine
CID 77096482

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol?
The IUPAC name of (1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol (CID 97209953) is (1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol.
What is the SMILES notation for (1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol?
The canonical SMILES for (1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol is C[C@@H](O)c1cccc(N(C)Cc2cc(-c3ccccc3)no2)n1.
What is the InChIKey of (1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol?
The InChIKey is MDGCUKKHBPDZLC-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-13(22)16-9-6-10-18(19-16)21(2)12-15-11-17(20-23-15)14-7-4-3-5-8-14/h3-11,13,22H,12H2,1-2H3/t13-/m1/s1.
What are the key properties of (1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol?
(1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol has a molecular weight of 309.37 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol is sourced from PubChem (CID 97209953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).