1-(2-amino-1-phenylpropyl)piperidin-3-ol

C14H22N2O — CID 55017645

IUPAC1-(2-amino-1-phenylpropyl)piperidin-3-ol
SMILESCC(N)C(c1ccccc1)N1CCCC(O)C1
InChIInChI=1S/C14H22N2O/c1-11(15)14(12-6-3-2-4-7-12)16-9-5-8-13(17)10-16/h2-4,6-7,11,13-14,17H,5,8-10,15H2,1H3
InChIKeyWLPUIQJHKCXPRI-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.53
Rot. Bonds3

About 1-(2-amino-1-phenylpropyl)piperidin-3-ol

1-(2-amino-1-phenylpropyl)piperidin-3-ol (PubChem CID 55017645) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(2-amino-1-phenylpropyl)piperidin-3-ol.

Molecular Properties

Compound Name1-(2-amino-1-phenylpropyl)piperidin-3-ol
PubChem CID55017645
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-(2-amino-1-phenylpropyl)piperidin-3-ol
SMILESCC(N)C(c1ccccc1)N1CCCC(O)C1
InChIInChI=1S/C14H22N2O/c1-11(15)14(12-6-3-2-4-7-12)16-9-5-8-13(17)10-16/h2-4,6-7,11,13-14,17H,5,8-10,15H2,1H3
InChIKeyWLPUIQJHKCXPRI-UHFFFAOYSA-N
XLogP1.53
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-amino-1-(4-fluorophenyl)propyl]piperidin-3-ol
CID 55016863
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-1-phenylpropan-2-amine
CID 79940901
1-[2-amino-1-(4-chlorophenyl)propyl]pyrrolidin-3-ol
CID 62942234
1-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-1-phenylpropan-2-amine
CID 115559024
(3S)-1-[(2S)-1-phenylpropan-2-yl]piperidin-3-ol
CID 129494667
1-(3-methoxypyrrolidin-1-yl)-1-phenylpropan-2-amine
CID 103530869
1-[(1S)-1-phenylethyl]pyrrolidin-3-ol
CID 69382807
1-[2-amino-1-(4-bromophenyl)butyl]piperidin-3-ol
CID 55016025
1-(2-methyl-1-phenylpropyl)piperidine-3-carboxylic acid
CID 65054275
1-(2-amino-1-phenylpropyl)pyrrolidine-2-carboxamide
CID 55017137
(3R,4R)-4-amino-1-(2-methyl-1-phenylpropyl)piperidin-3-ol
CID 67305621
2-(2-amino-1-phenylpropyl)-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
CID 82857052

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-1-phenylpropyl)piperidin-3-ol?
The IUPAC name of 1-(2-amino-1-phenylpropyl)piperidin-3-ol (CID 55017645) is 1-(2-amino-1-phenylpropyl)piperidin-3-ol.
What is the SMILES notation for 1-(2-amino-1-phenylpropyl)piperidin-3-ol?
The canonical SMILES for 1-(2-amino-1-phenylpropyl)piperidin-3-ol is CC(N)C(c1ccccc1)N1CCCC(O)C1.
What is the InChIKey of 1-(2-amino-1-phenylpropyl)piperidin-3-ol?
The InChIKey is WLPUIQJHKCXPRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11(15)14(12-6-3-2-4-7-12)16-9-5-8-13(17)10-16/h2-4,6-7,11,13-14,17H,5,8-10,15H2,1H3.
What are the key properties of 1-(2-amino-1-phenylpropyl)piperidin-3-ol?
1-(2-amino-1-phenylpropyl)piperidin-3-ol has a molecular weight of 234.34 g/mol, XLogP of 1.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-1-phenylpropyl)piperidin-3-ol is sourced from PubChem (CID 55017645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).