N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide

C20H24N2O2 — CID 118791586

IUPACN-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide
SMILESCc1cccc(-c2cccc(C(=O)NCCC3(O)CCCC3)c2)n1
InChIInChI=1S/C20H24N2O2/c1-15-6-4-9-18(22-15)16-7-5-8-17(14-16)19(23)21-13-12-20(24)10-2-3-11-20/h4-9,14,24H,2-3,10-13H2,1H3,(H,21,23)
InChIKeyHDQXPSYTHZEFTC-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.48
Rot. Bonds5

About N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide

N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide (PubChem CID 118791586) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound NameN-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide
PubChem CID118791586
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide
SMILESCc1cccc(-c2cccc(C(=O)NCCC3(O)CCCC3)c2)n1
InChIInChI=1S/C20H24N2O2/c1-15-6-4-9-18(22-15)16-7-5-8-17(14-16)19(23)21-13-12-20(24)10-2-3-11-20/h4-9,14,24H,2-3,10-13H2,1H3,(H,21,23)
InChIKeyHDQXPSYTHZEFTC-UHFFFAOYSA-N
XLogP3.48
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide?
The IUPAC name of N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide (CID 118791586) is N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide?
The canonical SMILES for N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide is Cc1cccc(-c2cccc(C(=O)NCCC3(O)CCCC3)c2)n1.
What is the InChIKey of N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide?
The InChIKey is HDQXPSYTHZEFTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-15-6-4-9-18(22-15)16-7-5-8-17(14-16)19(23)21-13-12-20(24)10-2-3-11-20/h4-9,14,24H,2-3,10-13H2,1H3,(H,21,23).
What are the key properties of N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide?
N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide has a molecular weight of 324.42 g/mol, XLogP of 3.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-hydroxycyclopentyl)ethyl]-3-(6-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 118791586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).