4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide

C15H21N3O3 — CID 115569779

IUPAC4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide
SMILESCC(NCc1ccc(C(N)=O)cc1)C(=O)N1CCOCC1
InChIInChI=1S/C15H21N3O3/c1-11(15(20)18-6-8-21-9-7-18)17-10-12-2-4-13(5-3-12)14(16)19/h2-5,11,17H,6-10H2,1H3,(H2,16,19)
InChIKeyILXVAQHAEWRPMV-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.12
Rot. Bonds5

About 4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide

4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide (PubChem CID 115569779) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide.

Molecular Properties

Compound Name4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide
PubChem CID115569779
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide
SMILESCC(NCc1ccc(C(N)=O)cc1)C(=O)N1CCOCC1
InChIInChI=1S/C15H21N3O3/c1-11(15(20)18-6-8-21-9-7-18)17-10-12-2-4-13(5-3-12)14(16)19/h2-5,11,17H,6-10H2,1H3,(H2,16,19)
InChIKeyILXVAQHAEWRPMV-UHFFFAOYSA-N
XLogP0.12
TPSA84.66 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 ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide with MolForge

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Related Compounds

2-[(4-fluorophenyl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 43083712
2-[(4-ethoxyphenyl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 115593323
methyl 5-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]furan-2-carboxylate
CID 115628854
4-[(morpholin-4-ylamino)methyl]benzamide
CID 83012003
2-[(3-chloro-4-methoxyphenyl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 115653757
methyl 2-[(4-carbamoylphenyl)methylamino]propanoate
CID 60781943
4-[[1-(oxan-4-yl)ethylamino]methyl]benzamide
CID 103768922
4-[[[1-(methylamino)-1-oxopropan-2-yl]amino]methyl]benzamide
CID 60674315
2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 112683112
2-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]-1-morpholin-4-ylpropan-1-one
CID 115621805
4-[4-(2-amino-3-morpholin-4-yl-3-oxopropyl)phenoxy]benzamide
CID 25007040
2-(2,3-dihydro-1-benzofuran-5-ylmethylamino)-1-piperidin-1-ylpropan-1-one
CID 60930882

Frequently Asked Questions

What is the IUPAC name of 4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide?
The IUPAC name of 4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide (CID 115569779) is 4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide.
What is the SMILES notation for 4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide?
The canonical SMILES for 4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide is CC(NCc1ccc(C(N)=O)cc1)C(=O)N1CCOCC1.
What is the InChIKey of 4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide?
The InChIKey is ILXVAQHAEWRPMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-11(15(20)18-6-8-21-9-7-18)17-10-12-2-4-13(5-3-12)14(16)19/h2-5,11,17H,6-10H2,1H3,(H2,16,19).
What are the key properties of 4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide?
4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide has a molecular weight of 291.35 g/mol, XLogP of 0.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide is sourced from PubChem (CID 115569779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).