(2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide

C22H27N3O2 — CID 92613459

IUPAC(2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide
SMILESO=C(Nc1ccccc1OCc1ccccn1)[C@H]1CCN1C1CCCCC1
InChIInChI=1S/C22H27N3O2/c26-22(20-13-15-25(20)18-9-2-1-3-10-18)24-19-11-4-5-12-21(19)27-16-17-8-6-7-14-23-17/h4-8,11-12,14,18,20H,1-3,9-10,13,15-16H2,(H,24,26)/t20-/m1/s1
InChIKeyYADYIDRUQOHUHM-HXUWFJFHSA-N
MW365.48 g/mol
LogP4.01
Rot. Bonds6

About (2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide

(2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide (PubChem CID 92613459) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is (2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide
PubChem CID92613459
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC Name(2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide
SMILESO=C(Nc1ccccc1OCc1ccccn1)[C@H]1CCN1C1CCCCC1
InChIInChI=1S/C22H27N3O2/c26-22(20-13-15-25(20)18-9-2-1-3-10-18)24-19-11-4-5-12-21(19)27-16-17-8-6-7-14-23-17/h4-8,11-12,14,18,20H,1-3,9-10,13,15-16H2,(H,24,26)/t20-/m1/s1
InChIKeyYADYIDRUQOHUHM-HXUWFJFHSA-N
XLogP4.01
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide?
The IUPAC name of (2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide (CID 92613459) is (2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide.
What is the SMILES notation for (2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide?
The canonical SMILES for (2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide is O=C(Nc1ccccc1OCc1ccccn1)[C@H]1CCN1C1CCCCC1.
What is the InChIKey of (2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide?
The InChIKey is YADYIDRUQOHUHM-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H27N3O2/c26-22(20-13-15-25(20)18-9-2-1-3-10-18)24-19-11-4-5-12-21(19)27-16-17-8-6-7-14-23-17/h4-8,11-12,14,18,20H,1-3,9-10,13,15-16H2,(H,24,26)/t20-/m1/s1.
What are the key properties of (2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide?
(2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide has a molecular weight of 365.48 g/mol, XLogP of 4.01, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-cyclohexyl-N-[2-(pyridin-2-ylmethoxy)phenyl]azetidine-2-carboxamide is sourced from PubChem (CID 92613459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).