2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol

C15H24N2O2 — CID 102636123

IUPAC2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol
SMILESCCc1cc(CO)cc(N(C)C2CCCCC2O)n1
InChIInChI=1S/C15H24N2O2/c1-3-12-8-11(10-18)9-15(16-12)17(2)13-6-4-5-7-14(13)19/h8-9,13-14,18-19H,3-7,10H2,1-2H3
InChIKeyAXNSCFMTOOLECI-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.88
Rot. Bonds4

About 2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol

2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol (PubChem CID 102636123) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol
PubChem CID102636123
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol
SMILESCCc1cc(CO)cc(N(C)C2CCCCC2O)n1
InChIInChI=1S/C15H24N2O2/c1-3-12-8-11(10-18)9-15(16-12)17(2)13-6-4-5-7-14(13)19/h8-9,13-14,18-19H,3-7,10H2,1-2H3
InChIKeyAXNSCFMTOOLECI-UHFFFAOYSA-N
XLogP1.88
TPSA56.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]-methylamino]cyclohexan-1-ol
CID 102640092
2-[[4-(hydroxymethyl)-1,3-oxazol-2-yl]-methylamino]cyclohexan-1-ol
CID 102636138
[2-ethyl-6-[methyl(2,2,2-trifluoroethyl)amino]-4-pyridinyl]methanol
CID 113380475
2-[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-methylamino]cyclohexan-1-ol
CID 102640212
2-[4-(hydroxymethyl)-N,2-dimethylanilino]cyclohexan-1-ol
CID 102632814
2-[(6-amino-2-propylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol
CID 102640210
2-[[5-chloro-6-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol
CID 102636125
4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine
CID 113380658
2-[4-(aminomethyl)-2,6-difluoro-N-methylanilino]cyclohexan-1-ol
CID 102631487
2-[[2-amino-6-(propylamino)pyrimidin-4-yl]-methylamino]cyclohexan-1-ol
CID 102640144
6-[(2-hydroxycyclohexyl)-methylamino]pyridine-3-carbaldehyde
CID 102632652
2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol
CID 102640233

Frequently Asked Questions

What is the IUPAC name of 2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol?
The IUPAC name of 2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol (CID 102636123) is 2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol.
What is the SMILES notation for 2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol?
The canonical SMILES for 2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol is CCc1cc(CO)cc(N(C)C2CCCCC2O)n1.
What is the InChIKey of 2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol?
The InChIKey is AXNSCFMTOOLECI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-12-8-11(10-18)9-15(16-12)17(2)13-6-4-5-7-14(13)19/h8-9,13-14,18-19H,3-7,10H2,1-2H3.
What are the key properties of 2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol?
2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol has a molecular weight of 264.37 g/mol, XLogP of 1.88, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol is sourced from PubChem (CID 102636123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).