cyclohexyl-(6-methyl-3-pyridinyl)methanone

C13H17NO — CID 63155759

IUPACcyclohexyl-(6-methyl-3-pyridinyl)methanone
SMILESCc1ccc(C(=O)C2CCCCC2)cn1
InChIInChI=1S/C13H17NO/c1-10-7-8-12(9-14-10)13(15)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3
InChIKeyAUVMDNVVHLWPPX-UHFFFAOYSA-N
MW203.29 g/mol
LogP3.15
Rot. Bonds2

About cyclohexyl-(6-methyl-3-pyridinyl)methanone

cyclohexyl-(6-methyl-3-pyridinyl)methanone (PubChem CID 63155759) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is cyclohexyl-(6-methyl-3-pyridinyl)methanone.

Molecular Properties

Compound Namecyclohexyl-(6-methyl-3-pyridinyl)methanone
PubChem CID63155759
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC Namecyclohexyl-(6-methyl-3-pyridinyl)methanone
SMILESCc1ccc(C(=O)C2CCCCC2)cn1
InChIInChI=1S/C13H17NO/c1-10-7-8-12(9-14-10)13(15)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3
InChIKeyAUVMDNVVHLWPPX-UHFFFAOYSA-N
XLogP3.15
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(aminomethyl)cyclohexyl]-(6-methyl-3-pyridinyl)methanone
CID 116592296
6-bicyclo[3.1.0]hexanyl-(6-methyl-3-pyridinyl)methanone
CID 114971615
(6-methyl-3-pyridinyl)-[3-(trifluoromethyl)cyclohexyl]methanone
CID 105098763
(2-methylcyclopentyl)-(6-methyl-3-pyridinyl)methanone
CID 107186922
N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide
CID 39975112
N-(2-chloroethyl)-N-cyclohexyl-6-methylpyridine-3-carboxamide
CID 63391189
(3-methyl-2-methylsulfanylazepan-1-yl)-(6-methyl-3-pyridinyl)methanone
CID 166876433
(6-chloro-3-pyridinyl)-cyclopropylmethanone
CID 11550101
2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone
CID 105119165
(4-bromophenyl)-cycloheptylmethanone
CID 63492666
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(6-methyl-3-pyridinyl)methanone
CID 105115340
cyclohexyl-(3,4-dichlorophenyl)methanone
CID 11601310

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-(6-methyl-3-pyridinyl)methanone?
The IUPAC name of cyclohexyl-(6-methyl-3-pyridinyl)methanone (CID 63155759) is cyclohexyl-(6-methyl-3-pyridinyl)methanone.
What is the SMILES notation for cyclohexyl-(6-methyl-3-pyridinyl)methanone?
The canonical SMILES for cyclohexyl-(6-methyl-3-pyridinyl)methanone is Cc1ccc(C(=O)C2CCCCC2)cn1.
What is the InChIKey of cyclohexyl-(6-methyl-3-pyridinyl)methanone?
The InChIKey is AUVMDNVVHLWPPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-10-7-8-12(9-14-10)13(15)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3.
What are the key properties of cyclohexyl-(6-methyl-3-pyridinyl)methanone?
cyclohexyl-(6-methyl-3-pyridinyl)methanone has a molecular weight of 203.29 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(6-methyl-3-pyridinyl)methanone is sourced from PubChem (CID 63155759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).