4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide

C21H24N2O3 — CID 23071756

IUPAC4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide
SMILESO=C(Nc1cccc(Oc2ccccc2)c1)N1CCC(O)(C2CC2)CC1
InChIInChI=1S/C21H24N2O3/c24-20(23-13-11-21(25,12-14-23)16-9-10-16)22-17-5-4-8-19(15-17)26-18-6-2-1-3-7-18/h1-8,15-16,25H,9-14H2,(H,22,24)
InChIKeyIIDHERPALXAUTO-UHFFFAOYSA-N
MW352.43 g/mol
LogP4.25
Rot. Bonds4

About 4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide

4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide (PubChem CID 23071756) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is 4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide
PubChem CID23071756
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC Name4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide
SMILESO=C(Nc1cccc(Oc2ccccc2)c1)N1CCC(O)(C2CC2)CC1
InChIInChI=1S/C21H24N2O3/c24-20(23-13-11-21(25,12-14-23)16-9-10-16)22-17-5-4-8-19(15-17)26-18-6-2-1-3-7-18/h1-8,15-16,25H,9-14H2,(H,22,24)
InChIKeyIIDHERPALXAUTO-UHFFFAOYSA-N
XLogP4.25
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-cyclohexyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide
CID 23071773
4-cyclopentyl-4-hydroxy-N-(4-phenoxyphenyl)piperidine-1-carboxamide
CID 23071843
4-cyclopentyl-4-hydroxy-N-(3-methoxyphenyl)piperidine-1-carboxamide
CID 23071820
4-(1-hydroxyethyl)-N-(3-phenoxyphenyl)piperidine-1-carboxamide
CID 111424875
3-(1-hydroxyethyl)-N-(3-phenoxyphenyl)pyrrolidine-1-carboxamide
CID 75503696
N-[3-(4-carbamoylphenoxy)-5-(4-fluorophenoxy)phenyl]-4-cycloheptyl-4-hydroxypiperidine-1-carboxamide
CID 90308950
3-methyl-1-[(3-pyridin-4-yloxyphenyl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 122080073
(3S)-3-[(1R)-1-hydroxyethyl]-N-(3-phenoxyphenyl)piperidine-1-carboxamide
CID 97238064
4a-hydroxy-N-phenyl-1,3,4,5,6,7,8,8a-octahydroisoquinoline-2-carboxamide
CID 81103476
2-ethyl-N-(3-phenoxyphenyl)morpholine-4-carboxamide
CID 75405540
(3S,4S)-1-[(3-phenoxyphenyl)carbamoyl]-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 122078048
1-N-(3-methylphenyl)-4-N-(2-phenoxyphenyl)piperidine-1,4-dicarboxamide
CID 60541262

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide?
The IUPAC name of 4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide (CID 23071756) is 4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide is O=C(Nc1cccc(Oc2ccccc2)c1)N1CCC(O)(C2CC2)CC1.
What is the InChIKey of 4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide?
The InChIKey is IIDHERPALXAUTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c24-20(23-13-11-21(25,12-14-23)16-9-10-16)22-17-5-4-8-19(15-17)26-18-6-2-1-3-7-18/h1-8,15-16,25H,9-14H2,(H,22,24).
What are the key properties of 4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide?
4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide has a molecular weight of 352.43 g/mol, XLogP of 4.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 23071756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).