2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide

C23H26N4O — CID 134006987

IUPAC2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide
SMILESCc1cc(NC2CCN(CC(=O)Nc3ccccc3)CC2)nc2ccccc12
InChIInChI=1S/C23H26N4O/c1-17-15-22(26-21-10-6-5-9-20(17)21)24-19-11-13-27(14-12-19)16-23(28)25-18-7-3-2-4-8-18/h2-10,15,19H,11-14,16H2,1H3,(H,24,26)(H,25,28)
InChIKeyBDQFROBMSRNORF-UHFFFAOYSA-N
MW374.49 g/mol
LogP4.06
Rot. Bonds5

About 2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide

2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide (PubChem CID 134006987) has the molecular formula C23H26N4O and a molecular weight of 374.49 g/mol. Its IUPAC name is 2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide
PubChem CID134006987
Molecular FormulaC23H26N4O
Molecular Weight374.49 g/mol
Exact Mass374.21
IUPAC Name2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide
SMILESCc1cc(NC2CCN(CC(=O)Nc3ccccc3)CC2)nc2ccccc12
InChIInChI=1S/C23H26N4O/c1-17-15-22(26-21-10-6-5-9-20(17)21)24-19-11-13-27(14-12-19)16-23(28)25-18-7-3-2-4-8-18/h2-10,15,19H,11-14,16H2,1H3,(H,24,26)(H,25,28)
InChIKeyBDQFROBMSRNORF-UHFFFAOYSA-N
XLogP4.06
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(4-methylquinolin-2-yl)piperazin-1-yl]-N-phenylacetamide
CID 134017909
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2,2-dimethylpropanamide
CID 3220730
2-[4-[(3-tert-butyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)amino]piperidin-1-yl]-N-phenylacetamide
CID 133489053
2-(4-hydroxypiperidin-1-yl)-N-phenylacetamide
CID 39902294
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]cyclobutanecarboxamide
CID 16589812
N-(1-ethylpiperidin-3-yl)-4-methylquinolin-2-amine
CID 122561309
2-(4-ethoxypiperidin-1-yl)-N-phenylacetamide
CID 47358518
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-thiophen-2-ylquinoline-4-carboxamide
CID 25397691
6-[[1-(2-anilino-2-oxoethyl)piperidin-4-yl]carbamoyl]pyridine-2-carboxylic acid
CID 119180037
2-[4-[[2-(4-bromo-2-chloro-6-methylphenoxy)acetyl]amino]piperidin-1-yl]-N-phenylacetamide
CID 16613375
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-5-ethyl-4-methylthiophene-2-carboxamide
CID 16613362
N-phenyl-2-[4-(thieno[3,2-d]pyrimidin-4-ylamino)piperidin-1-yl]acetamide
CID 24623746

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide?
The IUPAC name of 2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide (CID 134006987) is 2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide.
What is the SMILES notation for 2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide?
The canonical SMILES for 2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide is Cc1cc(NC2CCN(CC(=O)Nc3ccccc3)CC2)nc2ccccc12.
What is the InChIKey of 2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide?
The InChIKey is BDQFROBMSRNORF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O/c1-17-15-22(26-21-10-6-5-9-20(17)21)24-19-11-13-27(14-12-19)16-23(28)25-18-7-3-2-4-8-18/h2-10,15,19H,11-14,16H2,1H3,(H,24,26)(H,25,28).
What are the key properties of 2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide?
2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide has a molecular weight of 374.49 g/mol, XLogP of 4.06, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-methylquinolin-2-yl)amino]piperidin-1-yl]-N-phenylacetamide is sourced from PubChem (CID 134006987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).