(1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol

C14H22N2O — CID 112742222

IUPAC(1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol
SMILESNC1CCCN(CC[C@@H](O)c2ccccc2)C1
InChIInChI=1S/C14H22N2O/c15-13-7-4-9-16(11-13)10-8-14(17)12-5-2-1-3-6-12/h1-3,5-6,13-14,17H,4,7-11,15H2/t13?,14-/m1/s1
InChIKeyPHCNQGTWHIUXMA-ARLHGKGLSA-N
MW234.34 g/mol
LogP1.53
Rot. Bonds4

About (1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol

(1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol (PubChem CID 112742222) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is (1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol.

Molecular Properties

Compound Name(1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol
PubChem CID112742222
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name(1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol
SMILESNC1CCCN(CC[C@@H](O)c2ccccc2)C1
InChIInChI=1S/C14H22N2O/c15-13-7-4-9-16(11-13)10-8-14(17)12-5-2-1-3-6-12/h1-3,5-6,13-14,17H,4,7-11,15H2/t13?,14-/m1/s1
InChIKeyPHCNQGTWHIUXMA-ARLHGKGLSA-N
XLogP1.53
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
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-(3-hydroxy-3-phenylpropyl)piperidin-3-ol
CID 55094317
(3S)-1-[(3R)-3-phenylbutyl]piperidin-3-amine
CID 129366524
1-(3-hydroxy-3-phenylpropyl)pyrrolidin-3-ol
CID 62943227
(3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine
CID 58636592
3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-1-phenylpropan-1-ol
CID 115562031
3-(3,4-dimethylpiperidin-1-yl)-1-phenylpropan-1-ol
CID 22770544
1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol
CID 70278414
(1R)-3-[2-[(3R)-3-hydroxy-3-phenylpropyl]-2,8-diazaspiro[5.5]undecan-8-yl]-1-phenylpropan-1-ol
CID 166211934
3-[4-[(dimethylamino)methyl]piperidin-1-yl]-1-phenylpropan-1-ol
CID 62612776
(3R)-1-(3-phenoxypropyl)piperidin-3-amine
CID 102977310
3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-1-phenylpropan-1-ol
CID 62613754
1-(4-aminophenyl)-3-(4-benzylpiperidin-1-yl)propan-1-ol
CID 82070868

Frequently Asked Questions

What is the IUPAC name of (1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol?
The IUPAC name of (1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol (CID 112742222) is (1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol.
What is the SMILES notation for (1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol?
The canonical SMILES for (1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol is NC1CCCN(CC[C@@H](O)c2ccccc2)C1.
What is the InChIKey of (1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol?
The InChIKey is PHCNQGTWHIUXMA-ARLHGKGLSA-N. The full InChI is InChI=1S/C14H22N2O/c15-13-7-4-9-16(11-13)10-8-14(17)12-5-2-1-3-6-12/h1-3,5-6,13-14,17H,4,7-11,15H2/t13?,14-/m1/s1.
What are the key properties of (1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol?
(1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 1.53, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol is sourced from PubChem (CID 112742222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).