(2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine

C16H15ClN4O — CID 164640774

IUPAC(2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine
SMILESClc1ccc([C@@H]2CN(c3nccc4[nH]cnc34)CCO2)cc1
InChIInChI=1S/C16H15ClN4O/c17-12-3-1-11(2-4-12)14-9-21(7-8-22-14)16-15-13(5-6-18-16)19-10-20-15/h1-6,10,14H,7-9H2,(H,19,20)/t14-/m0/s1
InChIKeyOFJMUMUOFDBVLT-AWEZNQCLSA-N
MW314.78 g/mol
LogP3.19
Rot. Bonds2

About (2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine

(2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine (PubChem CID 164640774) has the molecular formula C16H15ClN4O and a molecular weight of 314.78 g/mol. Its IUPAC name is (2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine.

Molecular Properties

Compound Name(2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine
PubChem CID164640774
Molecular FormulaC16H15ClN4O
Molecular Weight314.78 g/mol
Exact Mass314.09
IUPAC Name(2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine
SMILESClc1ccc([C@@H]2CN(c3nccc4[nH]cnc34)CCO2)cc1
InChIInChI=1S/C16H15ClN4O/c17-12-3-1-11(2-4-12)14-9-21(7-8-22-14)16-15-13(5-6-18-16)19-10-20-15/h1-6,10,14H,7-9H2,(H,19,20)/t14-/m0/s1
InChIKeyOFJMUMUOFDBVLT-AWEZNQCLSA-N
XLogP3.19
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.78
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine?
The IUPAC name of (2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine (CID 164640774) is (2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine.
What is the SMILES notation for (2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine?
The canonical SMILES for (2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine is Clc1ccc([C@@H]2CN(c3nccc4[nH]cnc34)CCO2)cc1.
What is the InChIKey of (2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine?
The InChIKey is OFJMUMUOFDBVLT-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H15ClN4O/c17-12-3-1-11(2-4-12)14-9-21(7-8-22-14)16-15-13(5-6-18-16)19-10-20-15/h1-6,10,14H,7-9H2,(H,19,20)/t14-/m0/s1.
What are the key properties of (2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine?
(2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine has a molecular weight of 314.78 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-chlorophenyl)-4-(1H-imidazo[4,5-c]pyridin-4-yl)morpholine is sourced from PubChem (CID 164640774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).