N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide

C19H28FN3O3 — CID 134041911

IUPACN-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
SMILESCC(C)C(NC(=O)CN(C)CC(=O)N1CCOCC1)c1ccc(F)cc1
InChIInChI=1S/C19H28FN3O3/c1-14(2)19(15-4-6-16(20)7-5-15)21-17(24)12-22(3)13-18(25)23-8-10-26-11-9-23/h4-7,14,19H,8-13H2,1-3H3,(H,21,24)
InChIKeyNSCXKPOLTHXPEZ-UHFFFAOYSA-N
MW365.45 g/mol
LogP1.43
Rot. Bonds7

About N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide

N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide (PubChem CID 134041911) has the molecular formula C19H28FN3O3 and a molecular weight of 365.45 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
PubChem CID134041911
Molecular FormulaC19H28FN3O3
Molecular Weight365.45 g/mol
Exact Mass365.21
IUPAC NameN-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
SMILESCC(C)C(NC(=O)CN(C)CC(=O)N1CCOCC1)c1ccc(F)cc1
InChIInChI=1S/C19H28FN3O3/c1-14(2)19(15-4-6-16(20)7-5-15)21-17(24)12-22(3)13-18(25)23-8-10-26-11-9-23/h4-7,14,19H,8-13H2,1-3H3,(H,21,24)
InChIKeyNSCXKPOLTHXPEZ-UHFFFAOYSA-N
XLogP1.43
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.45
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The IUPAC name of N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide (CID 134041911) is N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The canonical SMILES for N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide is CC(C)C(NC(=O)CN(C)CC(=O)N1CCOCC1)c1ccc(F)cc1.
What is the InChIKey of N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The InChIKey is NSCXKPOLTHXPEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28FN3O3/c1-14(2)19(15-4-6-16(20)7-5-15)21-17(24)12-22(3)13-18(25)23-8-10-26-11-9-23/h4-7,14,19H,8-13H2,1-3H3,(H,21,24).
What are the key properties of N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide has a molecular weight of 365.45 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)-2-methylpropyl]-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide is sourced from PubChem (CID 134041911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).