N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide

C17H26FN3O — CID 95200536

IUPACN-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide
SMILESCc1ccc(NC(=O)CN[C@H](C)CN2CCCCC2)c(F)c1
InChIInChI=1S/C17H26FN3O/c1-13-6-7-16(15(18)10-13)20-17(22)11-19-14(2)12-21-8-4-3-5-9-21/h6-7,10,14,19H,3-5,8-9,11-12H2,1-2H3,(H,20,22)/t14-/m1/s1
InChIKeyLNNWEYNIYFPBMS-CQSZACIVSA-N
MW307.41 g/mol
LogP2.54
Rot. Bonds6

About N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide

N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide (PubChem CID 95200536) has the molecular formula C17H26FN3O and a molecular weight of 307.41 g/mol. Its IUPAC name is N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide.

Molecular Properties

Compound NameN-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide
PubChem CID95200536
Molecular FormulaC17H26FN3O
Molecular Weight307.41 g/mol
Exact Mass307.21
IUPAC NameN-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide
SMILESCc1ccc(NC(=O)CN[C@H](C)CN2CCCCC2)c(F)c1
InChIInChI=1S/C17H26FN3O/c1-13-6-7-16(15(18)10-13)20-17(22)11-19-14(2)12-21-8-4-3-5-9-21/h6-7,10,14,19H,3-5,8-9,11-12H2,1-2H3,(H,20,22)/t14-/m1/s1
InChIKeyLNNWEYNIYFPBMS-CQSZACIVSA-N
XLogP2.54
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.41
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide 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-(2-fluoro-4-methylphenyl)-2-(1-piperidin-1-ylpropan-2-ylamino)acetamide
CID 56712249
2-(butan-2-ylamino)-N-(2-fluoro-4-methylphenyl)acetamide
CID 60646943
N-(2-methylphenyl)-2-(1-pyrrolidin-1-ylpropan-2-ylamino)acetamide
CID 61474184
N-(3-fluorophenyl)-2-(1-pyrrolidin-1-ylpropan-2-ylamino)acetamide
CID 61474061
N-(2-fluoro-4-methylphenyl)propanamide
CID 60628124
N-(2-fluoro-4-methylphenyl)-2-[[(1R)-1-phenylethyl]amino]acetamide
CID 8898768
2-hydrazinyl-5-methyl-N-(1-piperidin-1-ylpropan-2-yl)benzamide
CID 62511679
2-(2-fluoro-4-methylanilino)-1-piperidin-1-ylethanone
CID 28826126
2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-N-(2-fluoro-4-methylphenyl)acetamide
CID 9307279
N-(4-bromo-2-fluorophenyl)-2-(butan-2-ylamino)acetamide
CID 54917740
2-[[(1S)-1-(2,4-difluorophenyl)ethyl]amino]-N-(2-fluoro-4-methylphenyl)acetamide
CID 9370429
3-fluoro-4-(1-pyrrolidin-1-ylpropan-2-ylamino)benzoic acid
CID 62711373

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide?
The IUPAC name of N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide (CID 95200536) is N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide.
What is the SMILES notation for N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide?
The canonical SMILES for N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide is Cc1ccc(NC(=O)CN[C@H](C)CN2CCCCC2)c(F)c1.
What is the InChIKey of N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide?
The InChIKey is LNNWEYNIYFPBMS-CQSZACIVSA-N. The full InChI is InChI=1S/C17H26FN3O/c1-13-6-7-16(15(18)10-13)20-17(22)11-19-14(2)12-21-8-4-3-5-9-21/h6-7,10,14,19H,3-5,8-9,11-12H2,1-2H3,(H,20,22)/t14-/m1/s1.
What are the key properties of N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide?
N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide has a molecular weight of 307.41 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-4-methylphenyl)-2-[[(2R)-1-piperidin-1-ylpropan-2-yl]amino]acetamide is sourced from PubChem (CID 95200536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).