N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide

C11H20N2O2 — CID 102632036

IUPACN-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide
SMILESCN(C(=O)C1CNC1)C1CCCCC1O
InChIInChI=1S/C11H20N2O2/c1-13(11(15)8-6-12-7-8)9-4-2-3-5-10(9)14/h8-10,12,14H,2-7H2,1H3
InChIKeySLUHYWYMPNWIMW-UHFFFAOYSA-N
MW212.29 g/mol
LogP-0.03
Rot. Bonds2

About N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide

N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide (PubChem CID 102632036) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide
PubChem CID102632036
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide
SMILESCN(C(=O)C1CNC1)C1CCCCC1O
InChIInChI=1S/C11H20N2O2/c1-13(11(15)8-6-12-7-8)9-4-2-3-5-10(9)14/h8-10,12,14H,2-7H2,1H3
InChIKeySLUHYWYMPNWIMW-UHFFFAOYSA-N
XLogP-0.03
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide?
The IUPAC name of N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide (CID 102632036) is N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide?
The canonical SMILES for N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide is CN(C(=O)C1CNC1)C1CCCCC1O.
What is the InChIKey of N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide?
The InChIKey is SLUHYWYMPNWIMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-13(11(15)8-6-12-7-8)9-4-2-3-5-10(9)14/h8-10,12,14H,2-7H2,1H3.
What are the key properties of N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide?
N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide has a molecular weight of 212.29 g/mol, XLogP of -0.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclohexyl)-N-methylazetidine-3-carboxamide is sourced from PubChem (CID 102632036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).