ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide

C20H32N4O — CID 143224290

IUPACethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide
SMILESCC.O=C(CN1CCC(Cc2ccccn2)CC1)NC1CC=CNC1
InChIInChI=1S/C18H26N4O.C2H6/c23-18(21-17-5-3-8-19-13-17)14-22-10-6-15(7-11-22)12-16-4-1-2-9-20-16;1-2/h1-4,8-9,15,17,19H,5-7,10-14H2,(H,21,23);1-2H3
InChIKeyBFLOOYHSOBXQMF-UHFFFAOYSA-N
MW344.50 g/mol
LogP2.35
Rot. Bonds5

About ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide

ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide (PubChem CID 143224290) has the molecular formula C20H32N4O and a molecular weight of 344.50 g/mol. Its IUPAC name is ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide.

Molecular Properties

Compound Nameethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide
PubChem CID143224290
Molecular FormulaC20H32N4O
Molecular Weight344.50 g/mol
Exact Mass344.26
IUPAC Nameethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide
SMILESCC.O=C(CN1CCC(Cc2ccccn2)CC1)NC1CC=CNC1
InChIInChI=1S/C18H26N4O.C2H6/c23-18(21-17-5-3-8-19-13-17)14-22-10-6-15(7-11-22)12-16-4-1-2-9-20-16;1-2/h1-4,8-9,15,17,19H,5-7,10-14H2,(H,21,23);1-2H3
InChIKeyBFLOOYHSOBXQMF-UHFFFAOYSA-N
XLogP2.35
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.50
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide with MolForge

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Related Compounds

2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(6-sulfanylidenehex-4-en-2-yl)acetamide
CID 143224255
N-cyclohexyl-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide
CID 68873162
2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 79333901
2-[[1-(2-methylpropyl)piperidin-4-yl]methyl]pyridine
CID 174571259
2-(cyclopropylmethylamino)-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide
CID 119901369
N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide
CID 37476276
N-cycloheptyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 4884816
methyl 4-[4-(pyridin-2-ylmethyl)piperidine-1-carbonyl]benzoate
CID 122137060
2-[[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]methyl]pyridine
CID 95816983
1-[3-(pyridin-2-ylmethyl)piperidin-1-yl]ethanone
CID 110254207
N-(4-aminocyclohexyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide;dihydrochloride
CID 119477889
N-cyclopent-3-en-1-yl-4-(pyridin-2-ylmethyl)piperazine-1-carboxamide
CID 86797484

Frequently Asked Questions

What is the IUPAC name of ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide?
The IUPAC name of ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide (CID 143224290) is ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide.
What is the SMILES notation for ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide?
The canonical SMILES for ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide is CC.O=C(CN1CCC(Cc2ccccn2)CC1)NC1CC=CNC1.
What is the InChIKey of ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide?
The InChIKey is BFLOOYHSOBXQMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O.C2H6/c23-18(21-17-5-3-8-19-13-17)14-22-10-6-15(7-11-22)12-16-4-1-2-9-20-16;1-2/h1-4,8-9,15,17,19H,5-7,10-14H2,(H,21,23);1-2H3.
What are the key properties of ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide?
ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide has a molecular weight of 344.50 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-[4-(pyridin-2-ylmethyl)piperidin-1-yl]-N-(1,2,3,4-tetrahydropyridin-3-yl)acetamide is sourced from PubChem (CID 143224290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).