N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide

C15H21N3O3 — CID 51106839

IUPACN-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide
SMILESCNC(=O)CCNC(=O)c1ccccc1N1CCOCC1
InChIInChI=1S/C15H21N3O3/c1-16-14(19)6-7-17-15(20)12-4-2-3-5-13(12)18-8-10-21-11-9-18/h2-5H,6-11H2,1H3,(H,16,19)(H,17,20)
InChIKeyLWXGJNZYFZAEFY-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.39
Rot. Bonds5

About N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide

N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide (PubChem CID 51106839) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide.

Molecular Properties

Compound NameN-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide
PubChem CID51106839
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC NameN-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide
SMILESCNC(=O)CCNC(=O)c1ccccc1N1CCOCC1
InChIInChI=1S/C15H21N3O3/c1-16-14(19)6-7-17-15(20)12-4-2-3-5-13(12)18-8-10-21-11-9-18/h2-5H,6-11H2,1H3,(H,16,19)(H,17,20)
InChIKeyLWXGJNZYFZAEFY-UHFFFAOYSA-N
XLogP0.39
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide?
The IUPAC name of N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide (CID 51106839) is N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide.
What is the SMILES notation for N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide?
The canonical SMILES for N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide is CNC(=O)CCNC(=O)c1ccccc1N1CCOCC1.
What is the InChIKey of N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide?
The InChIKey is LWXGJNZYFZAEFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-16-14(19)6-7-17-15(20)12-4-2-3-5-13(12)18-8-10-21-11-9-18/h2-5H,6-11H2,1H3,(H,16,19)(H,17,20).
What are the key properties of N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide?
N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide has a molecular weight of 291.35 g/mol, XLogP of 0.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(methylamino)-3-oxopropyl]-2-morpholin-4-ylbenzamide is sourced from PubChem (CID 51106839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).