N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide

C26H41N3O2 — CID 135213249

IUPACN-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide
SMILESCCCc1c(C(C)=O)ncc(NC(=O)C2CCCCCCCCC2)c1N1CCCCC1
InChIInChI=1S/C26H41N3O2/c1-3-14-22-24(20(2)30)27-19-23(25(22)29-17-12-9-13-18-29)28-26(31)21-15-10-7-5-4-6-8-11-16-21/h19,21H,3-18H2,1-2H3,(H,28,31)
InChIKeyKKCXHWWWGWFEKI-UHFFFAOYSA-N
MW427.63 g/mol
LogP6.31
Rot. Bonds6

About N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide

N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide (PubChem CID 135213249) has the molecular formula C26H41N3O2 and a molecular weight of 427.63 g/mol. Its IUPAC name is N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide.

Molecular Properties

Compound NameN-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide
PubChem CID135213249
Molecular FormulaC26H41N3O2
Molecular Weight427.63 g/mol
Exact Mass427.32
IUPAC NameN-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide
SMILESCCCc1c(C(C)=O)ncc(NC(=O)C2CCCCCCCCC2)c1N1CCCCC1
InChIInChI=1S/C26H41N3O2/c1-3-14-22-24(20(2)30)27-19-23(25(22)29-17-12-9-13-18-29)28-26(31)21-15-10-7-5-4-6-8-11-16-21/h19,21H,3-18H2,1-2H3,(H,28,31)
InChIKeyKKCXHWWWGWFEKI-UHFFFAOYSA-N
XLogP6.31
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.63
LogP ≤ 56.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-cyclooctyl-6-ethyl-5-propyl-3-pyridinyl)cyclooctanecarboxamide
CID 139313066
N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)cyclohexanecarboxamide
CID 53200841
N-[6-(butanoylamino)-4-methyl-3-pyridinyl]cyclohexanecarboxamide
CID 1452762
N-[5-(azepan-1-yl)-2-pyridinyl]cyclobutanecarboxamide
CID 113031088
N-(4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)cyclononanecarboxamide
CID 135213240
N-(4-methyl-2-pyrrolidin-1-ylphenyl)cyclohexanecarboxamide
CID 168512570
N-(2,4-diethoxypyrimidin-5-yl)cyclobutanecarboxamide
CID 122304432
N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide
CID 110426214
N-(5-aminosulfanyl-1-methylpyrazol-4-yl)cyclohexanecarboxamide
CID 145182676
4-(cyclohexanecarbonylamino)-1-ethyl-N-methylpyrazole-3-carboxamide
CID 19410874
N-(4-methyl-2,3-dihydrofuro[2,3-b]pyridin-5-yl)cycloheptanecarboxamide
CID 146803946
3-(cyclooctanecarbonylamino)pyridine-2-carboxylic acid
CID 104740375

Frequently Asked Questions

What is the IUPAC name of N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide?
The IUPAC name of N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide (CID 135213249) is N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide.
What is the SMILES notation for N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide?
The canonical SMILES for N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide is CCCc1c(C(C)=O)ncc(NC(=O)C2CCCCCCCCC2)c1N1CCCCC1.
What is the InChIKey of N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide?
The InChIKey is KKCXHWWWGWFEKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H41N3O2/c1-3-14-22-24(20(2)30)27-19-23(25(22)29-17-12-9-13-18-29)28-26(31)21-15-10-7-5-4-6-8-11-16-21/h19,21H,3-18H2,1-2H3,(H,28,31).
What are the key properties of N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide?
N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide has a molecular weight of 427.63 g/mol, XLogP of 6.31, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-acetyl-4-piperidin-1-yl-5-propyl-3-pyridinyl)cyclodecanecarboxamide is sourced from PubChem (CID 135213249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).