N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide

C26H35N3O3 — CID 59529212

IUPACN-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide
SMILESO=C(Cc1ccc(-c2ccc(OCCN3CCOCC3)cc2)nc1)NCCC1CCCC1
InChIInChI=1S/C26H35N3O3/c30-26(27-12-11-21-3-1-2-4-21)19-22-5-10-25(28-20-22)23-6-8-24(9-7-23)32-18-15-29-13-16-31-17-14-29/h5-10,20-21H,1-4,11-19H2,(H,27,30)
InChIKeyHNAWFTIZBLWGRZ-UHFFFAOYSA-N
MW437.58 g/mol
LogP3.70
Rot. Bonds10

About N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide

N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide (PubChem CID 59529212) has the molecular formula C26H35N3O3 and a molecular weight of 437.58 g/mol. Its IUPAC name is N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide
PubChem CID59529212
Molecular FormulaC26H35N3O3
Molecular Weight437.58 g/mol
Exact Mass437.27
IUPAC NameN-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide
SMILESO=C(Cc1ccc(-c2ccc(OCCN3CCOCC3)cc2)nc1)NCCC1CCCC1
InChIInChI=1S/C26H35N3O3/c30-26(27-12-11-21-3-1-2-4-21)19-22-5-10-25(28-20-22)23-6-8-24(9-7-23)32-18-15-29-13-16-31-17-14-29/h5-10,20-21H,1-4,11-19H2,(H,27,30)
InChIKeyHNAWFTIZBLWGRZ-UHFFFAOYSA-N
XLogP3.70
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.58
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide?
The IUPAC name of N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide (CID 59529212) is N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide.
What is the SMILES notation for N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide?
The canonical SMILES for N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide is O=C(Cc1ccc(-c2ccc(OCCN3CCOCC3)cc2)nc1)NCCC1CCCC1.
What is the InChIKey of N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide?
The InChIKey is HNAWFTIZBLWGRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H35N3O3/c30-26(27-12-11-21-3-1-2-4-21)19-22-5-10-25(28-20-22)23-6-8-24(9-7-23)32-18-15-29-13-16-31-17-14-29/h5-10,20-21H,1-4,11-19H2,(H,27,30).
What are the key properties of N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide?
N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide has a molecular weight of 437.58 g/mol, XLogP of 3.70, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylethyl)-2-[6-[4-(2-morpholin-4-ylethoxy)phenyl]-3-pyridinyl]acetamide is sourced from PubChem (CID 59529212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).