2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide

C19H22ClN3O3 — CID 46581557

IUPAC2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
SMILESCC(Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C19H22ClN3O3/c1-14(26-17-5-3-2-4-16(17)20)19(24)22-13-15-6-7-18(21-12-15)23-8-10-25-11-9-23/h2-7,12,14H,8-11,13H2,1H3,(H,22,24)
InChIKeyHERDWZZBWABRGJ-UHFFFAOYSA-N
MW375.86 g/mol
LogP2.66
Rot. Bonds6

About 2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide

2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide (PubChem CID 46581557) has the molecular formula C19H22ClN3O3 and a molecular weight of 375.86 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
PubChem CID46581557
Molecular FormulaC19H22ClN3O3
Molecular Weight375.86 g/mol
Exact Mass375.13
IUPAC Name2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
SMILESCC(Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C19H22ClN3O3/c1-14(26-17-5-3-2-4-16(17)20)19(24)22-13-15-6-7-18(21-12-15)23-8-10-25-11-9-23/h2-7,12,14H,8-11,13H2,1H3,(H,22,24)
InChIKeyHERDWZZBWABRGJ-UHFFFAOYSA-N
XLogP2.66
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.86
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenoxypropanamide
CID 18145200
2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide
CID 53282971
2-methoxy-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 47303387
(2R)-2-(2-chlorophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]propanamide
CID 39643721
3-chloro-2-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 62727165
2-methyl-3-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-3-oxopropanoic acid
CID 114897147
3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide
CID 17489984
2-benzylsulfanyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 47046949
1-(2-methoxyphenyl)-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 41430289
(2S)-2-(2-chlorophenoxy)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide
CID 94015153
2-(2-chlorophenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)propanamide
CID 90544210
2-(2-chlorophenoxy)-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propanamide
CID 48626689

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide (CID 46581557) is 2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide is CC(Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCOCC2)nc1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide?
The InChIKey is HERDWZZBWABRGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN3O3/c1-14(26-17-5-3-2-4-16(17)20)19(24)22-13-15-6-7-18(21-12-15)23-8-10-25-11-9-23/h2-7,12,14H,8-11,13H2,1H3,(H,22,24).
What are the key properties of 2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide?
2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide has a molecular weight of 375.86 g/mol, XLogP of 2.66, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide is sourced from PubChem (CID 46581557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).