4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide

C17H25N3O3 — CID 120559975

IUPAC4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide
SMILESCC(N)CCC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1
InChIInChI=1S/C17H25N3O3/c1-13(18)2-7-16(21)19-15-5-3-14(4-6-15)12-17(22)20-8-10-23-11-9-20/h3-6,13H,2,7-12,18H2,1H3,(H,19,21)
InChIKeyKEXBATOPKWMECT-UHFFFAOYSA-N
MW319.40 g/mol
LogP1.15
Rot. Bonds6

About 4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide

4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide (PubChem CID 120559975) has the molecular formula C17H25N3O3 and a molecular weight of 319.40 g/mol. Its IUPAC name is 4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide.

Molecular Properties

Compound Name4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide
PubChem CID120559975
Molecular FormulaC17H25N3O3
Molecular Weight319.40 g/mol
Exact Mass319.19
IUPAC Name4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide
SMILESCC(N)CCC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1
InChIInChI=1S/C17H25N3O3/c1-13(18)2-7-16(21)19-15-5-3-14(4-6-15)12-17(22)20-8-10-23-11-9-20/h3-6,13H,2,7-12,18H2,1H3,(H,19,21)
InChIKeyKEXBATOPKWMECT-UHFFFAOYSA-N
XLogP1.15
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]butanamide
CID 46455504
3-(2-aminophenyl)-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]propanamide;hydrochloride
CID 120608729
4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]benzamide
CID 119712469
1-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]cyclohexane-1-carboxamide
CID 119283363
2-amino-2-methyl-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide
CID 119712509
4-amino-N-[4-(azepan-1-ylmethyl)phenyl]pentanamide
CID 120565116
1-[[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 120549290
5-amino-2-methyl-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]benzamide
CID 120620954
1-morpholin-4-yl-2-(4-propan-2-ylsulfonylphenyl)ethanone
CID 16838369
(2R)-2-amino-N-[4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]phenyl]propanamide
CID 119860866
4-morpholin-4-yl-4-oxo-N-phenylbutanamide
CID 9341047
5-morpholin-4-yl-5-oxo-N-(4-sulfamoylphenyl)pentanamide
CID 1125536

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide?
The IUPAC name of 4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide (CID 120559975) is 4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide.
What is the SMILES notation for 4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide?
The canonical SMILES for 4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide is CC(N)CCC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1.
What is the InChIKey of 4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide?
The InChIKey is KEXBATOPKWMECT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-13(18)2-7-16(21)19-15-5-3-14(4-6-15)12-17(22)20-8-10-23-11-9-20/h3-6,13H,2,7-12,18H2,1H3,(H,19,21).
What are the key properties of 4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide?
4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide has a molecular weight of 319.40 g/mol, XLogP of 1.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide is sourced from PubChem (CID 120559975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).