(2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide

C20H22ClN3O2 — CID 97282888

IUPAC(2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
SMILESO=C(NC1(c2cccc(Cl)c2)CC1)[C@@H](c1cccnc1)N1CCOCC1
InChIInChI=1S/C20H22ClN3O2/c21-17-5-1-4-16(13-17)20(6-7-20)23-19(25)18(15-3-2-8-22-14-15)24-9-11-26-12-10-24/h1-5,8,13-14,18H,6-7,9-12H2,(H,23,25)/t18-/m1/s1
InChIKeyYHHZWOXWXDXRLR-GOSISDBHSA-N
MW371.87 g/mol
LogP2.91
Rot. Bonds5

About (2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide

(2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide (PubChem CID 97282888) has the molecular formula C20H22ClN3O2 and a molecular weight of 371.87 g/mol. Its IUPAC name is (2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide.

Molecular Properties

Compound Name(2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
PubChem CID97282888
Molecular FormulaC20H22ClN3O2
Molecular Weight371.87 g/mol
Exact Mass371.14
IUPAC Name(2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
SMILESO=C(NC1(c2cccc(Cl)c2)CC1)[C@@H](c1cccnc1)N1CCOCC1
InChIInChI=1S/C20H22ClN3O2/c21-17-5-1-4-16(13-17)20(6-7-20)23-19(25)18(15-3-2-8-22-14-15)24-9-11-26-12-10-24/h1-5,8,13-14,18H,6-7,9-12H2,(H,23,25)/t18-/m1/s1
InChIKeyYHHZWOXWXDXRLR-GOSISDBHSA-N
XLogP2.91
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.87
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[1-(3-chlorophenyl)-2,2-dipyridin-3-ylethyl]morpholine
CID 66962797
N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-ylacetamide
CID 110444239
N-(2-ethylsulfanylphenyl)-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 131917262
(2S)-N-[(2,4-difluorophenyl)methyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 97131048
(2S)-2-morpholin-4-yl-1-(1,4-oxazepan-4-yl)-2-pyridin-3-ylethanone
CID 97203647
(2R)-2-morpholin-4-yl-1-(1,4-oxazepan-4-yl)-2-pyridin-3-ylethanone
CID 97203648
N-(2-methylpropyl)-3-[(2-morpholin-4-yl-2-pyridin-3-ylacetyl)amino]benzamide
CID 131915912
N-[3-(5-methyltetrazol-1-yl)phenyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 131945875
N-[2-(dimethylsulfamoyl)ethyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 74234487
(2R)-N-[2-(2-fluorophenyl)ethyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 97192696
(2R)-N-(2-cyclohexylsulfanylethyl)-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 97188095
2-morpholin-4-yl-2-pyridin-3-yl-1-thiomorpholin-4-ylethanone
CID 74230397

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide?
The IUPAC name of (2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide (CID 97282888) is (2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide.
What is the SMILES notation for (2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide?
The canonical SMILES for (2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide is O=C(NC1(c2cccc(Cl)c2)CC1)[C@@H](c1cccnc1)N1CCOCC1.
What is the InChIKey of (2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide?
The InChIKey is YHHZWOXWXDXRLR-GOSISDBHSA-N. The full InChI is InChI=1S/C20H22ClN3O2/c21-17-5-1-4-16(13-17)20(6-7-20)23-19(25)18(15-3-2-8-22-14-15)24-9-11-26-12-10-24/h1-5,8,13-14,18H,6-7,9-12H2,(H,23,25)/t18-/m1/s1.
What are the key properties of (2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide?
(2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide has a molecular weight of 371.87 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[1-(3-chlorophenyl)cyclopropyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide is sourced from PubChem (CID 97282888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).