3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide

C17H32N2O2 — CID 90305101

IUPAC3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(NC(=O)C(C)(C)CN2CCC(O)CC2)CC1
InChIInChI=1S/C17H32N2O2/c1-13-4-6-14(7-5-13)18-16(21)17(2,3)12-19-10-8-15(20)9-11-19/h13-15,20H,4-12H2,1-3H3,(H,18,21)
InChIKeySUUQHCADPOUYKP-UHFFFAOYSA-N
MW296.45 g/mol
LogP2.16
Rot. Bonds4

About 3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide

3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide (PubChem CID 90305101) has the molecular formula C17H32N2O2 and a molecular weight of 296.45 g/mol. Its IUPAC name is 3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide.

Molecular Properties

Compound Name3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide
PubChem CID90305101
Molecular FormulaC17H32N2O2
Molecular Weight296.45 g/mol
Exact Mass296.25
IUPAC Name3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(NC(=O)C(C)(C)CN2CCC(O)CC2)CC1
InChIInChI=1S/C17H32N2O2/c1-13-4-6-14(7-5-13)18-16(21)17(2,3)12-19-10-8-15(20)9-11-19/h13-15,20H,4-12H2,1-3H3,(H,18,21)
InChIKeySUUQHCADPOUYKP-UHFFFAOYSA-N
XLogP2.16
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.45
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide?
The IUPAC name of 3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide (CID 90305101) is 3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide.
What is the SMILES notation for 3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide?
The canonical SMILES for 3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide is CC1CCC(NC(=O)C(C)(C)CN2CCC(O)CC2)CC1.
What is the InChIKey of 3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide?
The InChIKey is SUUQHCADPOUYKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2/c1-13-4-6-14(7-5-13)18-16(21)17(2,3)12-19-10-8-15(20)9-11-19/h13-15,20H,4-12H2,1-3H3,(H,18,21).
What are the key properties of 3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide?
3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide has a molecular weight of 296.45 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-hydroxypiperidin-1-yl)-2,2-dimethyl-N-(4-methylcyclohexyl)propanamide is sourced from PubChem (CID 90305101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).