N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide

C20H24N2O3 — CID 86981489

IUPACN-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)NCc1ccnc(OC2CCCC2)c1
InChIInChI=1S/C20H24N2O3/c1-15(24-17-7-3-2-4-8-17)20(23)22-14-16-11-12-21-19(13-16)25-18-9-5-6-10-18/h2-4,7-8,11-13,15,18H,5-6,9-10,14H2,1H3,(H,22,23)
InChIKeyNBEJMUDRGRBORO-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.49
Rot. Bonds7

About N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide

N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide (PubChem CID 86981489) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide.

Molecular Properties

Compound NameN-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide
PubChem CID86981489
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)NCc1ccnc(OC2CCCC2)c1
InChIInChI=1S/C20H24N2O3/c1-15(24-17-7-3-2-4-8-17)20(23)22-14-16-11-12-21-19(13-16)25-18-9-5-6-10-18/h2-4,7-8,11-13,15,18H,5-6,9-10,14H2,1H3,(H,22,23)
InChIKeyNBEJMUDRGRBORO-UHFFFAOYSA-N
XLogP3.49
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[(2-cyclopentyloxy-4-pyridinyl)methylamino]-1-oxopropan-2-yl]benzamide
CID 86981506
N-[(2-cyclobutyloxy-4-pyridinyl)methyl]-2-hydroxy-2-phenylacetamide
CID 75393518
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-methoxybenzamide
CID 86981497
(2S)-2-phenoxy-N-(pyridin-4-ylmethyl)propanamide
CID 670240
(2S)-2-phenoxy-N-[(2-pyridin-4-yl-4-pyridinyl)methyl]propanamide
CID 129354694
N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide
CID 120704184
N-[1-[(2-cyclopentyloxy-4-pyridinyl)methylamino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-methylpropanamide
CID 55659212
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-3-propoxybenzamide
CID 55842196
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]pyrazine-2-carboxamide
CID 53499351
1-[(2-cyclopentyloxy-4-pyridinyl)methyl]-3-[(1S)-1-(oxan-4-yl)ethyl]urea
CID 129381997
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-methylindole-3-carboxamide
CID 75403194
5-[(2-cyclohexyloxy-4-pyridinyl)methylcarbamoyl]pyrazine-2-carboxylic acid
CID 120690264

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide?
The IUPAC name of N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide (CID 86981489) is N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide.
What is the SMILES notation for N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide?
The canonical SMILES for N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide is CC(Oc1ccccc1)C(=O)NCc1ccnc(OC2CCCC2)c1.
What is the InChIKey of N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide?
The InChIKey is NBEJMUDRGRBORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-15(24-17-7-3-2-4-8-17)20(23)22-14-16-11-12-21-19(13-16)25-18-9-5-6-10-18/h2-4,7-8,11-13,15,18H,5-6,9-10,14H2,1H3,(H,22,23).
What are the key properties of N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide?
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide has a molecular weight of 340.42 g/mol, XLogP of 3.49, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-phenoxypropanamide is sourced from PubChem (CID 86981489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).