cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone

C19H21NO2 — CID 161157461

IUPACcyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone
SMILESCc1ccc(OCc2ccccc2)c(C(=O)C2CCCC2)n1
InChIInChI=1S/C19H21NO2/c1-14-11-12-17(22-13-15-7-3-2-4-8-15)18(20-14)19(21)16-9-5-6-10-16/h2-4,7-8,11-12,16H,5-6,9-10,13H2,1H3
InChIKeyYCBWQBXSLQMMRD-UHFFFAOYSA-N
MW295.38 g/mol
LogP4.34
Rot. Bonds5

About cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone

cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone (PubChem CID 161157461) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone.

Molecular Properties

Compound Namecyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone
PubChem CID161157461
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC Namecyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone
SMILESCc1ccc(OCc2ccccc2)c(C(=O)C2CCCC2)n1
InChIInChI=1S/C19H21NO2/c1-14-11-12-17(22-13-15-7-3-2-4-8-15)18(20-14)19(21)16-9-5-6-10-16/h2-4,7-8,11-12,16H,5-6,9-10,13H2,1H3
InChIKeyYCBWQBXSLQMMRD-UHFFFAOYSA-N
XLogP4.34
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 6-methyl-3-phenylmethoxypyridine-2-carboxylate
CID 145241727
6-methyl-3-(phenylmethoxymethoxy)pyridine-2-carboxylic acid
CID 102939706
3-(cyclobutylmethoxy)-6-methylpyridine-2-carboxylic acid
CID 79157043
methyl 2-(cyclohexanecarbonyl)-5-methoxy-4-phenylmethoxybenzoate
CID 142496966
(6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine
CID 58869463
2,6-dimethyl-4-phenylmethoxypyridine-3-carboxylic acid
CID 81053468
(3-chloro-4-phenylmethoxyphenyl)-cyclopropylmethanone
CID 82550709
3-[(3-bromo-4-methoxyphenyl)methoxy]-6-methylpyridine-2-carboxylic acid
CID 79156646
benzyl 3-methyl-6,7-bis(phenylmethoxy)quinoxaline-2-carboxylate
CID 86747625
[2-[hydroxy-(6-methyl-3-phenylmethoxy-2-pyridinyl)methyl]pyrrolidin-1-yl]-(2-hydroxyphenyl)methanone
CID 166791348
N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-methylcyclopentanecarboxamide
CID 9118265
3-(3-chloro-4-phenylmethoxyphenyl)-1-cyclopentylpropan-1-one
CID 58762761

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone?
The IUPAC name of cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone (CID 161157461) is cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone.
What is the SMILES notation for cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone?
The canonical SMILES for cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone is Cc1ccc(OCc2ccccc2)c(C(=O)C2CCCC2)n1.
What is the InChIKey of cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone?
The InChIKey is YCBWQBXSLQMMRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c1-14-11-12-17(22-13-15-7-3-2-4-8-15)18(20-14)19(21)16-9-5-6-10-16/h2-4,7-8,11-12,16H,5-6,9-10,13H2,1H3.
What are the key properties of cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone?
cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone has a molecular weight of 295.38 g/mol, XLogP of 4.34, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-(6-methyl-3-phenylmethoxy-2-pyridinyl)methanone is sourced from PubChem (CID 161157461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).