3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide

C20H24N2O3 — CID 110896856

IUPAC3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide
SMILESO=C(Nc1cccc(OCCc2ccccc2)c1)N1CCCC(O)C1
InChIInChI=1S/C20H24N2O3/c23-18-9-5-12-22(15-18)20(24)21-17-8-4-10-19(14-17)25-13-11-16-6-2-1-3-7-16/h1-4,6-8,10,14,18,23H,5,9,11-13,15H2,(H,21,24)
InChIKeySEYNYSYJDUWTBP-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.30
Rot. Bonds5

About 3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide

3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide (PubChem CID 110896856) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide
PubChem CID110896856
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide
SMILESO=C(Nc1cccc(OCCc2ccccc2)c1)N1CCCC(O)C1
InChIInChI=1S/C20H24N2O3/c23-18-9-5-12-22(15-18)20(24)21-17-8-4-10-19(14-17)25-13-11-16-6-2-1-3-7-16/h1-4,6-8,10,14,18,23H,5,9,11-13,15H2,(H,21,24)
InChIKeySEYNYSYJDUWTBP-UHFFFAOYSA-N
XLogP3.30
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-N-(3-propoxyphenyl)piperidine-1-carboxamide
CID 47202480
1-[[3-(2-phenylethoxy)phenyl]carbamoyl]piperidine-4-carboxylic acid
CID 122092864
2-[3-[(3-hydroxypiperidine-1-carbonyl)amino]phenyl]acetic acid
CID 65345639
N-(3-ethylphenyl)-3-hydroxypiperidine-1-carboxamide
CID 47032364
3-hydroxy-N-[3-(methoxymethyl)phenyl]piperidine-1-carboxamide
CID 51080395
(3R)-3-hydroxy-N-[3-(3-phenylpropyl)phenyl]pyrrolidine-1-carboxamide
CID 111431591
1-[[3-(2-methoxyethoxy)phenyl]carbamoyl]piperidine-3-carboxylic acid
CID 122076774
N-[3-(2-phenylethoxy)phenyl]-2-piperidin-1-ylacetamide
CID 54813456
(3R)-N-[3-(2-methoxyethoxy)phenyl]-3-phenylpyrrolidine-1-carboxamide
CID 95592117
N-(3-chlorophenyl)-3-hydroxypiperidine-1-carboxamide
CID 17392993
1-[[3-(2-anilino-2-oxoethoxy)phenyl]carbamoyl]piperidine-3-carboxylic acid
CID 122076825
(3R)-3-hydroxy-N-(3-methoxyphenyl)pyrrolidine-1-carboxamide
CID 63362733

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide?
The IUPAC name of 3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide (CID 110896856) is 3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide.
What is the SMILES notation for 3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide?
The canonical SMILES for 3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide is O=C(Nc1cccc(OCCc2ccccc2)c1)N1CCCC(O)C1.
What is the InChIKey of 3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide?
The InChIKey is SEYNYSYJDUWTBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c23-18-9-5-12-22(15-18)20(24)21-17-8-4-10-19(14-17)25-13-11-16-6-2-1-3-7-16/h1-4,6-8,10,14,18,23H,5,9,11-13,15H2,(H,21,24).
What are the key properties of 3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide?
3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide has a molecular weight of 340.42 g/mol, XLogP of 3.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-[3-(2-phenylethoxy)phenyl]piperidine-1-carboxamide is sourced from PubChem (CID 110896856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).