N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide

C18H26ClN3O2 — CID 91829242

IUPACN-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide
SMILESO=C(CCN1CCC(N2CCOCC2)CC1)Nc1cccc(Cl)c1
InChIInChI=1S/C18H26ClN3O2/c19-15-2-1-3-16(14-15)20-18(23)6-9-21-7-4-17(5-8-21)22-10-12-24-13-11-22/h1-3,14,17H,4-13H2,(H,20,23)
InChIKeyQPHHQDDYIDCZOM-UHFFFAOYSA-N
MW351.88 g/mol
LogP2.47
Rot. Bonds5

About N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide

N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide (PubChem CID 91829242) has the molecular formula C18H26ClN3O2 and a molecular weight of 351.88 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide
PubChem CID91829242
Molecular FormulaC18H26ClN3O2
Molecular Weight351.88 g/mol
Exact Mass351.17
IUPAC NameN-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide
SMILESO=C(CCN1CCC(N2CCOCC2)CC1)Nc1cccc(Cl)c1
InChIInChI=1S/C18H26ClN3O2/c19-15-2-1-3-16(14-15)20-18(23)6-9-21-7-4-17(5-8-21)22-10-12-24-13-11-22/h1-3,14,17H,4-13H2,(H,20,23)
InChIKeyQPHHQDDYIDCZOM-UHFFFAOYSA-N
XLogP2.47
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.88
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide?
The IUPAC name of N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide (CID 91829242) is N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide.
What is the SMILES notation for N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide?
The canonical SMILES for N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide is O=C(CCN1CCC(N2CCOCC2)CC1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide?
The InChIKey is QPHHQDDYIDCZOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26ClN3O2/c19-15-2-1-3-16(14-15)20-18(23)6-9-21-7-4-17(5-8-21)22-10-12-24-13-11-22/h1-3,14,17H,4-13H2,(H,20,23).
What are the key properties of N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide?
N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide has a molecular weight of 351.88 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-3-(4-morpholin-4-ylpiperidin-1-yl)propanamide is sourced from PubChem (CID 91829242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).