(5-amino-2-piperidin-1-ylphenyl)methanol

C12H18N2O — CID 118164480

IUPAC(5-amino-2-piperidin-1-ylphenyl)methanol
SMILESNc1ccc(N2CCCCC2)c(CO)c1
InChIInChI=1S/C12H18N2O/c13-11-4-5-12(10(8-11)9-15)14-6-2-1-3-7-14/h4-5,8,15H,1-3,6-7,9,13H2
InChIKeyDLOPNHLQMXRXND-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.75
Rot. Bonds2

About (5-amino-2-piperidin-1-ylphenyl)methanol

(5-amino-2-piperidin-1-ylphenyl)methanol (PubChem CID 118164480) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is (5-amino-2-piperidin-1-ylphenyl)methanol.

Molecular Properties

Compound Name(5-amino-2-piperidin-1-ylphenyl)methanol
PubChem CID118164480
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name(5-amino-2-piperidin-1-ylphenyl)methanol
SMILESNc1ccc(N2CCCCC2)c(CO)c1
InChIInChI=1S/C12H18N2O/c13-11-4-5-12(10(8-11)9-15)14-6-2-1-3-7-14/h4-5,8,15H,1-3,6-7,9,13H2
InChIKeyDLOPNHLQMXRXND-UHFFFAOYSA-N
XLogP1.75
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(3-amino-4-pyrrolidin-1-ylphenyl)methanol
CID 94830386
3-phenyl-4-pyrrolidin-1-ylaniline
CID 18371751
tert-butyl N-[2-(5-amino-2-pyrrolidin-1-ylphenyl)ethyl]carbamate
CID 139270530
[5-amino-2-(hydroxymethyl)phenyl]-piperidin-1-ylmethanone
CID 102538189
2-(5-chloro-2-piperidin-1-ylphenyl)ethanamine
CID 114860401
5-amino-N-ethyl-2-piperidin-1-ylbenzamide
CID 100651237
(6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol
CID 142617854
[5-chloro-2-(1,4-oxazepan-4-yl)phenyl]methanol
CID 114845567
5-amino-2-(azepan-1-yl)-N-methylbenzamide
CID 100651466
2-(5-methyl-2-piperidin-1-ylphenyl)ethanol
CID 117313218
4-amino-2-piperidin-1-ylbenzonitrile
CID 122504500
[5-amino-2-(2-methylpiperazin-1-yl)phenyl]methanol
CID 53444057

Frequently Asked Questions

What is the IUPAC name of (5-amino-2-piperidin-1-ylphenyl)methanol?
The IUPAC name of (5-amino-2-piperidin-1-ylphenyl)methanol (CID 118164480) is (5-amino-2-piperidin-1-ylphenyl)methanol.
What is the SMILES notation for (5-amino-2-piperidin-1-ylphenyl)methanol?
The canonical SMILES for (5-amino-2-piperidin-1-ylphenyl)methanol is Nc1ccc(N2CCCCC2)c(CO)c1.
What is the InChIKey of (5-amino-2-piperidin-1-ylphenyl)methanol?
The InChIKey is DLOPNHLQMXRXND-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c13-11-4-5-12(10(8-11)9-15)14-6-2-1-3-7-14/h4-5,8,15H,1-3,6-7,9,13H2.
What are the key properties of (5-amino-2-piperidin-1-ylphenyl)methanol?
(5-amino-2-piperidin-1-ylphenyl)methanol has a molecular weight of 206.29 g/mol, XLogP of 1.75, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-2-piperidin-1-ylphenyl)methanol is sourced from PubChem (CID 118164480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).