N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide

C21H32N4O2 — CID 143229638

IUPACN-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(N2CCCC(CCN(C=O)C3CCCCC3)C2)nc1
InChIInChI=1S/C21H32N4O2/c1-17(27)23-19-9-10-21(22-14-19)24-12-5-6-18(15-24)11-13-25(16-26)20-7-3-2-4-8-20/h9-10,14,16,18,20H,2-8,11-13,15H2,1H3,(H,23,27)
InChIKeyOZWAVIIUABIBAQ-UHFFFAOYSA-N
MW372.51 g/mol
LogP3.44
Rot. Bonds7

About N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide

N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide (PubChem CID 143229638) has the molecular formula C21H32N4O2 and a molecular weight of 372.51 g/mol. Its IUPAC name is N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide
PubChem CID143229638
Molecular FormulaC21H32N4O2
Molecular Weight372.51 g/mol
Exact Mass372.25
IUPAC NameN-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(N2CCCC(CCN(C=O)C3CCCCC3)C2)nc1
InChIInChI=1S/C21H32N4O2/c1-17(27)23-19-9-10-21(22-14-19)24-12-5-6-18(15-24)11-13-25(16-26)20-7-3-2-4-8-20/h9-10,14,16,18,20H,2-8,11-13,15H2,1H3,(H,23,27)
InChIKeyOZWAVIIUABIBAQ-UHFFFAOYSA-N
XLogP3.44
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.51
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[4-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-methylphenyl]acetamide
CID 143229805
ethane;ethyl N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-4-methyl-3-pyridinyl]carbamate
CID 143229820
N-cyclohexyl-N-[2-(1-quinolin-2-ylpiperidin-3-yl)ethyl]formamide;ethane
CID 143229721
N-[4-[3-[3-[cyclohexyl(formyl)amino]propyl]piperidin-1-yl]-3-(trifluoromethyl)phenyl]acetamide
CID 143229391
N-cyclohexyl-N-[2-[1-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazine-1-carbonyl]piperidin-3-yl]ethyl]formamide
CID 143229564
N-[4-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-methylphenyl]butanamide
CID 143229592
N-[4-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-fluorophenyl]cyclohexanecarboxamide;methanol
CID 143229655
N-cyclohexyl-N-[2-(1-phenylpiperidin-3-yl)ethyl]formamide
CID 143229397
N-cyclohexyl-N-[2-[1-(3-methyl-2-pyridinyl)piperidin-3-yl]ethyl]formamide;ethane
CID 143229407
N-(4-cyanocyclohexyl)-N-[2-[1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]ethyl]formamide
CID 143229364
propyl N-[4-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-fluorophenyl]carbamate
CID 143229718
N-cyclohexyl-N-[2-[1-(2,5-difluorophenyl)piperidin-3-yl]ethyl]formamide
CID 143229552

Frequently Asked Questions

What is the IUPAC name of N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide?
The IUPAC name of N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide (CID 143229638) is N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide.
What is the SMILES notation for N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide?
The canonical SMILES for N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide is CC(=O)Nc1ccc(N2CCCC(CCN(C=O)C3CCCCC3)C2)nc1.
What is the InChIKey of N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide?
The InChIKey is OZWAVIIUABIBAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H32N4O2/c1-17(27)23-19-9-10-21(22-14-19)24-12-5-6-18(15-24)11-13-25(16-26)20-7-3-2-4-8-20/h9-10,14,16,18,20H,2-8,11-13,15H2,1H3,(H,23,27).
What are the key properties of N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide?
N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide has a molecular weight of 372.51 g/mol, XLogP of 3.44, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[3-[2-[cyclohexyl(formyl)amino]ethyl]piperidin-1-yl]-3-pyridinyl]acetamide is sourced from PubChem (CID 143229638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).