4-(2-amino-1-piperidin-1-ylethyl)phenol

C13H20N2O — CID 16796139

IUPAC4-(2-amino-1-piperidin-1-ylethyl)phenol
SMILESNCC(c1ccc(O)cc1)N1CCCCC1
InChIInChI=1S/C13H20N2O/c14-10-13(15-8-2-1-3-9-15)11-4-6-12(16)7-5-11/h4-7,13,16H,1-3,8-10,14H2
InChIKeyKPRPABFHURPQFH-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.88
Rot. Bonds3

About 4-(2-amino-1-piperidin-1-ylethyl)phenol

4-(2-amino-1-piperidin-1-ylethyl)phenol (PubChem CID 16796139) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 4-(2-amino-1-piperidin-1-ylethyl)phenol.

Molecular Properties

Compound Name4-(2-amino-1-piperidin-1-ylethyl)phenol
PubChem CID16796139
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name4-(2-amino-1-piperidin-1-ylethyl)phenol
SMILESNCC(c1ccc(O)cc1)N1CCCCC1
InChIInChI=1S/C13H20N2O/c14-10-13(15-8-2-1-3-9-15)11-4-6-12(16)7-5-11/h4-7,13,16H,1-3,8-10,14H2
InChIKeyKPRPABFHURPQFH-UHFFFAOYSA-N
XLogP1.88
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(azepan-1-yl)-2-(4-methylphenyl)ethanamine
CID 9079311
2-(azepan-1-yl)-2-(4-fluorophenyl)ethanamine
CID 6484142
(2S)-2-(4-ethylphenyl)-2-piperidin-1-ylethanamine
CID 97182151
(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ylethanamine
CID 97182150
(2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine
CID 39254713
3-(2-amino-1-pyrrolidin-1-ylethyl)phenol
CID 16790598
2-(azepan-1-yl)-2-[4-(trifluoromethyl)phenyl]ethanamine
CID 16792257
4-(2-amino-1-piperidin-1-ylethyl)-N,N-dimethylaniline
CID 16642839
2-(azepan-1-yl)-2-(4-cyclopropylphenyl)ethanamine
CID 79984707
2-(4-chlorophenyl)-2-pyrrolidin-1-ylethanamine;oxalic acid
CID 45075211
2-(4-phenylmethoxyphenyl)-2-piperidin-1-ylethanamine
CID 16642929
2-[4-(difluoromethoxy)phenyl]-2-pyrrolidin-1-ylethanamine
CID 16790891

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-1-piperidin-1-ylethyl)phenol?
The IUPAC name of 4-(2-amino-1-piperidin-1-ylethyl)phenol (CID 16796139) is 4-(2-amino-1-piperidin-1-ylethyl)phenol.
What is the SMILES notation for 4-(2-amino-1-piperidin-1-ylethyl)phenol?
The canonical SMILES for 4-(2-amino-1-piperidin-1-ylethyl)phenol is NCC(c1ccc(O)cc1)N1CCCCC1.
What is the InChIKey of 4-(2-amino-1-piperidin-1-ylethyl)phenol?
The InChIKey is KPRPABFHURPQFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c14-10-13(15-8-2-1-3-9-15)11-4-6-12(16)7-5-11/h4-7,13,16H,1-3,8-10,14H2.
What are the key properties of 4-(2-amino-1-piperidin-1-ylethyl)phenol?
4-(2-amino-1-piperidin-1-ylethyl)phenol has a molecular weight of 220.32 g/mol, XLogP of 1.88, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-1-piperidin-1-ylethyl)phenol is sourced from PubChem (CID 16796139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).