4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide

C18H32N2O2 — CID 111438241

IUPAC4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide
SMILESCC(O)C1CCN(C(=O)NC2CC3CCC2(C)C3(C)C)CC1
InChIInChI=1S/C18H32N2O2/c1-12(21)13-6-9-20(10-7-13)16(22)19-15-11-14-5-8-18(15,4)17(14,2)3/h12-15,21H,5-11H2,1-4H3,(H,19,22)
InChIKeyHZAXOGFFGYRNLC-UHFFFAOYSA-N
MW308.47 g/mol
LogP3.00
Rot. Bonds2

About 4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide

4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide (PubChem CID 111438241) has the molecular formula C18H32N2O2 and a molecular weight of 308.47 g/mol. Its IUPAC name is 4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide
PubChem CID111438241
Molecular FormulaC18H32N2O2
Molecular Weight308.47 g/mol
Exact Mass308.25
IUPAC Name4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide
SMILESCC(O)C1CCN(C(=O)NC2CC3CCC2(C)C3(C)C)CC1
InChIInChI=1S/C18H32N2O2/c1-12(21)13-6-9-20(10-7-13)16(22)19-15-11-14-5-8-18(15,4)17(14,2)3/h12-15,21H,5-11H2,1-4H3,(H,19,22)
InChIKeyHZAXOGFFGYRNLC-UHFFFAOYSA-N
XLogP3.00
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.47
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide with MolForge

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Related Compounds

4-hydroxy-4-(trifluoromethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide
CID 109971086
4-[acetyl(methyl)amino]-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide
CID 53579800
1-[4-(4-Methylpiperidin-1-yl)butyl]-3-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)urea
CID 60480139
1-Ethyl-1-(2-hydroxyethyl)-3-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)urea
CID 60481049
3-(hydroxymethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide
CID 60481051
1-Butyl-1-(2-hydroxyethyl)-3-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)urea
CID 60481056
4-(2-bicyclo[2.2.1]heptanyl)-N-(5-hydroxy-4,4-dimethylpentyl)piperazine-1-carboxamide
CID 71857216
3-hydroxy-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide
CID 71892989
1-Cyclopropyl-1-(2-hydroxyethyl)-3-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)urea
CID 71940579
(3S)-3-hydroxy-N-[(1R,2R,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]piperidine-1-carboxamide
CID 98285210
1-cyclopropyl-1-(2-hydroxyethyl)-3-[(1R,2R,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]urea
CID 98306003
(3S)-3-(hydroxymethyl)-N-[(1R,2R,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]piperidine-1-carboxamide
CID 98646019

Frequently Asked Questions

What is the IUPAC name of 4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide?
The IUPAC name of 4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide (CID 111438241) is 4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide?
The canonical SMILES for 4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide is CC(O)C1CCN(C(=O)NC2CC3CCC2(C)C3(C)C)CC1.
What is the InChIKey of 4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide?
The InChIKey is HZAXOGFFGYRNLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O2/c1-12(21)13-6-9-20(10-7-13)16(22)19-15-11-14-5-8-18(15,4)17(14,2)3/h12-15,21H,5-11H2,1-4H3,(H,19,22).
What are the key properties of 4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide?
4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide has a molecular weight of 308.47 g/mol, XLogP of 3.00, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydroxyethyl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidine-1-carboxamide is sourced from PubChem (CID 111438241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).