(1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol

C19H25N3O — CID 95322338

IUPAC(1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol
SMILESC[C@H](c1cccnc1)N1CCN(C[C@H](O)c2ccccc2)CC1
InChIInChI=1S/C19H25N3O/c1-16(18-8-5-9-20-14-18)22-12-10-21(11-13-22)15-19(23)17-6-3-2-4-7-17/h2-9,14,16,19,23H,10-13,15H2,1H3/t16-,19+/m1/s1
InChIKeyJGCWZGKNRAHMEF-APWZRJJASA-N
MW311.43 g/mol
LogP2.49
Rot. Bonds5

About (1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol

(1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol (PubChem CID 95322338) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is (1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol
PubChem CID95322338
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name(1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol
SMILESC[C@H](c1cccnc1)N1CCN(C[C@H](O)c2ccccc2)CC1
InChIInChI=1S/C19H25N3O/c1-16(18-8-5-9-20-14-18)22-12-10-21(11-13-22)15-19(23)17-6-3-2-4-7-17/h2-9,14,16,19,23H,10-13,15H2,1H3/t16-,19+/m1/s1
InChIKeyJGCWZGKNRAHMEF-APWZRJJASA-N
XLogP2.49
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol with MolForge

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Related Compounds

(1S)-2-[4-[(1S)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]-1-phenylethanol
CID 95315467
2-(4-phenylpiperazin-1-yl)-1-pyridin-3-ylethanol
CID 3044988
(2R)-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]propanoic acid
CID 124512132
[3-[[4-(1-pyridin-3-ylethyl)piperazin-1-yl]methyl]oxetan-3-yl]methanol
CID 111976764
1-[2-(1,3-dioxolan-2-yl)ethyl]-4-(1-pyridin-3-ylethyl)piperazine
CID 75509202
1-[(1-phenylimidazol-2-yl)methyl]-4-(1-pyridin-3-ylethyl)piperazine
CID 166223958
1-phenyl-2-[4-(1,1,1-trifluoropropan-2-yl)piperazin-1-yl]ethanol
CID 111799260
2-methyl-1-[4-(1-pyridin-3-ylethyl)piperazin-1-yl]propan-1-one
CID 87038067
1-[4-[(2S)-2-hydroxy-2-phenylethyl]piperazin-1-yl]-2-pyridin-3-yloxyethanone
CID 95321520
1-phenyl-2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]ethanol
CID 111462476
1-(1-pyridin-3-ylethyl)piperidine-4-carboxylic acid
CID 4272805
2-[4-(4-chlorophenyl)piperazin-1-yl]-1-pyridin-3-ylethanol
CID 3044996

Frequently Asked Questions

What is the IUPAC name of (1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol?
The IUPAC name of (1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol (CID 95322338) is (1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol.
What is the SMILES notation for (1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol?
The canonical SMILES for (1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol is C[C@H](c1cccnc1)N1CCN(C[C@H](O)c2ccccc2)CC1.
What is the InChIKey of (1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol?
The InChIKey is JGCWZGKNRAHMEF-APWZRJJASA-N. The full InChI is InChI=1S/C19H25N3O/c1-16(18-8-5-9-20-14-18)22-12-10-21(11-13-22)15-19(23)17-6-3-2-4-7-17/h2-9,14,16,19,23H,10-13,15H2,1H3/t16-,19+/m1/s1.
What are the key properties of (1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol?
(1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol has a molecular weight of 311.43 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-phenyl-2-[4-[(1R)-1-pyridin-3-ylethyl]piperazin-1-yl]ethanol is sourced from PubChem (CID 95322338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).