2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide

C23H28F2N2O2 — CID 92989345

IUPAC2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide
SMILESCC(C)CN(C[C@H]1CN(Cc2cccc(F)c2)CCO1)C(=O)c1ccccc1F
InChIInChI=1S/C23H28F2N2O2/c1-17(2)13-27(23(28)21-8-3-4-9-22(21)25)16-20-15-26(10-11-29-20)14-18-6-5-7-19(24)12-18/h3-9,12,17,20H,10-11,13-16H2,1-2H3/t20-/m1/s1
InChIKeyJDPXCCWFZWZGDA-HXUWFJFHSA-N
MW402.49 g/mol
LogP3.96
Rot. Bonds7

About 2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide

2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide (PubChem CID 92989345) has the molecular formula C23H28F2N2O2 and a molecular weight of 402.49 g/mol. Its IUPAC name is 2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide
PubChem CID92989345
Molecular FormulaC23H28F2N2O2
Molecular Weight402.49 g/mol
Exact Mass402.21
IUPAC Name2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide
SMILESCC(C)CN(C[C@H]1CN(Cc2cccc(F)c2)CCO1)C(=O)c1ccccc1F
InChIInChI=1S/C23H28F2N2O2/c1-17(2)13-27(23(28)21-8-3-4-9-22(21)25)16-20-15-26(10-11-29-20)14-18-6-5-7-19(24)12-18/h3-9,12,17,20H,10-11,13-16H2,1-2H3/t20-/m1/s1
InChIKeyJDPXCCWFZWZGDA-HXUWFJFHSA-N
XLogP3.96
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.49
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[(2R)-4-[(2,6-difluorophenyl)methyl]morpholin-2-yl]methyl]-2-fluoro-N-(2-methylpropyl)benzamide
CID 92989347
N-[[4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)-4-(trifluoromethyl)benzamide
CID 42862141
3-fluoro-N-[[4-(2-hydroxybutyl)morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide
CID 46060233
3-fluoro-N-[[(2R)-4-[(2S)-2-hydroxy-3-methylbutyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide
CID 99732290
2-[[(2-fluorobenzoyl)-(2-methylpropyl)amino]methyl]-N-(3-methoxyphenyl)morpholine-4-carboxamide
CID 42862009
3-fluoro-N-[[(2R)-4-[(2S)-2-hydroxy-3-morpholin-4-ylpropyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide
CID 99729601
2-fluoro-N-(furan-2-ylmethyl)-N-[[4-[(4-methylphenyl)methyl]morpholin-2-yl]methyl]benzamide
CID 42862078
N-[[4-(2-fluorobenzoyl)morpholin-2-yl]methyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide
CID 42861566
2-(chloromethyl)-4-[(3-fluorophenyl)methyl]morpholine
CID 81213684
4-fluoro-N-[[4-(2-hydroxy-2-phenylethyl)morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide
CID 42849374
N-[[(2R)-4-(furan-2-carbonyl)morpholin-2-yl]methyl]-N-(2-methylpropyl)naphthalene-1-carboxamide
CID 93337592
N-[[4-(2-chlorobenzoyl)morpholin-2-yl]methyl]-N-(2-methylpropyl)naphthalene-1-carboxamide
CID 42861582

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide?
The IUPAC name of 2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide (CID 92989345) is 2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide?
The canonical SMILES for 2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide is CC(C)CN(C[C@H]1CN(Cc2cccc(F)c2)CCO1)C(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide?
The InChIKey is JDPXCCWFZWZGDA-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H28F2N2O2/c1-17(2)13-27(23(28)21-8-3-4-9-22(21)25)16-20-15-26(10-11-29-20)14-18-6-5-7-19(24)12-18/h3-9,12,17,20H,10-11,13-16H2,1-2H3/t20-/m1/s1.
What are the key properties of 2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide?
2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide has a molecular weight of 402.49 g/mol, XLogP of 3.96, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[[(2R)-4-[(3-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 92989345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).