N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide

C11H20N2O2 — CID 123284817

IUPACN-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide
SMILESCC1(C(=O)NC2CNC2O)CCCCC1
InChIInChI=1S/C11H20N2O2/c1-11(5-3-2-4-6-11)10(15)13-8-7-12-9(8)14/h8-9,12,14H,2-7H2,1H3,(H,13,15)
InChIKeyYVNICWRGEVNOGW-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.36
Rot. Bonds2

About N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide

N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide (PubChem CID 123284817) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide
PubChem CID123284817
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide
SMILESCC1(C(=O)NC2CNC2O)CCCCC1
InChIInChI=1S/C11H20N2O2/c1-11(5-3-2-4-6-11)10(15)13-8-7-12-9(8)14/h8-9,12,14H,2-7H2,1H3,(H,13,15)
InChIKeyYVNICWRGEVNOGW-UHFFFAOYSA-N
XLogP0.36
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylcyclopentane-1-carboxamide
CID 104927764
1-methyl-N-[(3R)-piperidin-3-yl]cyclopentane-1-carboxamide
CID 104645453
N-(4-chlorocyclohexyl)-1-methylcyclohexane-1-carboxamide
CID 106828990
N-[2-(chloromethyl)cyclopentyl]-1-methylcyclopentane-1-carboxamide
CID 106365855
1-methyl-N-[(3S)-pyrrolidin-3-yl]cyclobutane-1-carboxamide
CID 166176322
N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 110931002
N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide
CID 126981151
1,6,6-trimethyl-N-sulfanylcycloundecane-1-carboxamide
CID 134355563
N-cyclohexyl-1-methylcyclopropane-1-carboxamide
CID 130162659
1-methyl-N-[(1S)-2-oxocyclobutyl]cyclohexane-1-carboxamide
CID 149031374
1-methyl-N-(6-oxopiperidin-3-yl)cyclopentane-1-carboxamide
CID 78953464
4-[(3-methylpiperidine-3-carbonyl)amino]oxolane-3-carboxylic acid
CID 66240131

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide?
The IUPAC name of N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide (CID 123284817) is N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide.
What is the SMILES notation for N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide?
The canonical SMILES for N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide is CC1(C(=O)NC2CNC2O)CCCCC1.
What is the InChIKey of N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide?
The InChIKey is YVNICWRGEVNOGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-11(5-3-2-4-6-11)10(15)13-8-7-12-9(8)14/h8-9,12,14H,2-7H2,1H3,(H,13,15).
What are the key properties of N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide?
N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide has a molecular weight of 212.29 g/mol, XLogP of 0.36, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyazetidin-3-yl)-1-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 123284817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).