1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide

C18H26N2O3 — CID 110883481

IUPAC1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccccc1O)C1CCN(C2CCCCC2O)CC1
InChIInChI=1S/C18H26N2O3/c21-16-7-3-1-5-14(16)19-18(23)13-9-11-20(12-10-13)15-6-2-4-8-17(15)22/h1,3,5,7,13,15,17,21-22H,2,4,6,8-12H2,(H,19,23)
InChIKeyBQAGIKMNUPRVII-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.35
Rot. Bonds3

About 1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide

1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide (PubChem CID 110883481) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is 1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide
PubChem CID110883481
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Name1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccccc1O)C1CCN(C2CCCCC2O)CC1
InChIInChI=1S/C18H26N2O3/c21-16-7-3-1-5-14(16)19-18(23)13-9-11-20(12-10-13)15-6-2-4-8-17(15)22/h1,3,5,7,13,15,17,21-22H,2,4,6,8-12H2,(H,19,23)
InChIKeyBQAGIKMNUPRVII-UHFFFAOYSA-N
XLogP2.35
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

1-(2,2-dimethylpropanoyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide
CID 18126290
N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide
CID 837694
N-(2-hydroxyphenyl)-1-(1-pyrimidin-2-ylethyl)piperidine-4-carboxamide
CID 126839220
N-(2-hydroxyphenyl)-4-methylidenecyclohexane-1-carboxamide
CID 90904766
N-(2-hydroxyphenyl)-1-[(1R)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]piperidine-4-carboxamide
CID 41099612
1-[(3R)-1-(3,4-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide
CID 51514552
2-(cycloheptanecarbonylamino)benzoic acid
CID 55091870
cis-(1S,2R)-2-pyrrolidin-1-ylcyclohexan-1-ol
CID 23656399
1-[(2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxopropan-2-yl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide
CID 26385714
N-(2-bromophenyl)cyclopentanecarboxamide
CID 1228174
N-(2-hydroxyphenyl)-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide
CID 46665454
1-benzyl-N-(2-hydroxyphenyl)piperidine-3-carboxamide
CID 60563080

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide (CID 110883481) is 1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide is O=C(Nc1ccccc1O)C1CCN(C2CCCCC2O)CC1.
What is the InChIKey of 1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide?
The InChIKey is BQAGIKMNUPRVII-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c21-16-7-3-1-5-14(16)19-18(23)13-9-11-20(12-10-13)15-6-2-4-8-17(15)22/h1,3,5,7,13,15,17,21-22H,2,4,6,8-12H2,(H,19,23).
What are the key properties of 1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide?
1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide has a molecular weight of 318.42 g/mol, XLogP of 2.35, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxycyclohexyl)-N-(2-hydroxyphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 110883481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).