(1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol

C19H26N2O2 — CID 2106497

IUPAC(1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol
SMILESO[C@H](CNC[C@H](c1ccco1)N1CCCCC1)c1ccccc1
InChIInChI=1S/C19H26N2O2/c22-18(16-8-3-1-4-9-16)15-20-14-17(19-10-7-13-23-19)21-11-5-2-6-12-21/h1,3-4,7-10,13,17-18,20,22H,2,5-6,11-12,14-15H2/t17-,18-/m1/s1
InChIKeyQKQLDJIRSWQZPF-QZTJIDSGSA-N
MW314.43 g/mol
LogP3.13
Rot. Bonds7

About (1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol

(1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol (PubChem CID 2106497) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is (1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol.

Molecular Properties

Compound Name(1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol
PubChem CID2106497
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC Name(1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol
SMILESO[C@H](CNC[C@H](c1ccco1)N1CCCCC1)c1ccccc1
InChIInChI=1S/C19H26N2O2/c22-18(16-8-3-1-4-9-16)15-20-14-17(19-10-7-13-23-19)21-11-5-2-6-12-21/h1,3-4,7-10,13,17-18,20,22H,2,5-6,11-12,14-15H2/t17-,18-/m1/s1
InChIKeyQKQLDJIRSWQZPF-QZTJIDSGSA-N
XLogP3.13
TPSA48.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol with MolForge

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Related Compounds

N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine
CID 83380875
2-(azepan-1-yl)-N-ethyl-2-(furan-2-yl)ethanamine
CID 22692497
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2,2-diphenylacetamide;hydrochloride
CID 52984942
N-(cyclopropylmethyl)-2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine
CID 43654889
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine
CID 112815907
4-[[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]methyl]benzoic acid
CID 122030017
(2R)-2-(dimethylamino)-N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2-phenylacetamide
CID 94956250
2-(diethylamino)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-phenylacetamide
CID 56538321
N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-phenylsulfanylacetamide
CID 35354735
N-(furan-2-ylmethyl)-2-phenyl-2-pyrrolidin-1-ylethanamine
CID 43180875
4-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]phenol
CID 43181226
2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol
CID 81399970

Frequently Asked Questions

What is the IUPAC name of (1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol?
The IUPAC name of (1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol (CID 2106497) is (1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol.
What is the SMILES notation for (1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol?
The canonical SMILES for (1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol is O[C@H](CNC[C@H](c1ccco1)N1CCCCC1)c1ccccc1.
What is the InChIKey of (1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol?
The InChIKey is QKQLDJIRSWQZPF-QZTJIDSGSA-N. The full InChI is InChI=1S/C19H26N2O2/c22-18(16-8-3-1-4-9-16)15-20-14-17(19-10-7-13-23-19)21-11-5-2-6-12-21/h1,3-4,7-10,13,17-18,20,22H,2,5-6,11-12,14-15H2/t17-,18-/m1/s1.
What are the key properties of (1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol?
(1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol has a molecular weight of 314.43 g/mol, XLogP of 3.13, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol is sourced from PubChem (CID 2106497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).