2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide

C24H26N4O2 — CID 175872549

IUPAC2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide
SMILESNC(=O)Cc1ccccc1NC1CCN(C(=O)Cc2ccc3ncccc3c2)CC1
InChIInChI=1S/C24H26N4O2/c25-23(29)16-19-4-1-2-6-22(19)27-20-9-12-28(13-10-20)24(30)15-17-7-8-21-18(14-17)5-3-11-26-21/h1-8,11,14,20,27H,9-10,12-13,15-16H2,(H2,25,29)
InChIKeyZOUBCFJJDAHOQC-UHFFFAOYSA-N
MW402.50 g/mol
LogP2.91
Rot. Bonds6

About 2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide

2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide (PubChem CID 175872549) has the molecular formula C24H26N4O2 and a molecular weight of 402.50 g/mol. Its IUPAC name is 2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide.

Molecular Properties

Compound Name2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide
PubChem CID175872549
Molecular FormulaC24H26N4O2
Molecular Weight402.50 g/mol
Exact Mass402.21
IUPAC Name2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide
SMILESNC(=O)Cc1ccccc1NC1CCN(C(=O)Cc2ccc3ncccc3c2)CC1
InChIInChI=1S/C24H26N4O2/c25-23(29)16-19-4-1-2-6-22(19)27-20-9-12-28(13-10-20)24(30)15-17-7-8-21-18(14-17)5-3-11-26-21/h1-8,11,14,20,27H,9-10,12-13,15-16H2,(H2,25,29)
InChIKeyZOUBCFJJDAHOQC-UHFFFAOYSA-N
XLogP2.91
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.50
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(2-nitroanilino)piperidin-1-yl]-2-quinolin-6-ylethanone
CID 155234146
1-[4-(cyclobutylamino)piperidin-1-yl]-2-quinolin-6-ylethanone
CID 154867921
1-[4-[2-amino-6-(trifluoromethyl)anilino]piperidin-1-yl]-2-quinolin-6-ylethanone
CID 155234309
4-[2-(2-amino-2-oxoethyl)anilino]piperidine-1-carboxamide
CID 43789647
1-[4-[2-(aminomethyl)anilino]piperidin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone
CID 155233947
2-[2-[(1-propylpiperidin-4-yl)amino]phenyl]acetamide
CID 43738460
2-quinolin-6-yl-1-[4-[7-(trifluoromethyl)-2,3-dihydrobenzimidazol-1-yl]piperidin-1-yl]ethanone
CID 155672294
2-[2-(pyrrolidin-3-ylamino)phenyl]acetamide
CID 79731342
N-[1-[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]-7-(trifluoromethyl)benzimidazol-2-yl]acetamide
CID 155248372
2-[2-[[4-(trifluoromethyl)cyclohexyl]amino]phenyl]acetamide
CID 64754665
1-[3-(3-chlorophenyl)azetidin-1-yl]-2-quinolin-6-ylethanone
CID 167832627
4-(quinolin-6-ylmethylamino)cyclohexane-1-carboxamide
CID 61042772

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide?
The IUPAC name of 2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide (CID 175872549) is 2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide.
What is the SMILES notation for 2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide?
The canonical SMILES for 2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide is NC(=O)Cc1ccccc1NC1CCN(C(=O)Cc2ccc3ncccc3c2)CC1.
What is the InChIKey of 2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide?
The InChIKey is ZOUBCFJJDAHOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O2/c25-23(29)16-19-4-1-2-6-22(19)27-20-9-12-28(13-10-20)24(30)15-17-7-8-21-18(14-17)5-3-11-26-21/h1-8,11,14,20,27H,9-10,12-13,15-16H2,(H2,25,29).
What are the key properties of 2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide?
2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide has a molecular weight of 402.50 g/mol, XLogP of 2.91, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[1-(2-quinolin-6-ylacetyl)piperidin-4-yl]amino]phenyl]acetamide is sourced from PubChem (CID 175872549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).