2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol

C14H22N2O — CID 56694973

IUPAC2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol
SMILESCc1ccc(C(O)CNC2CCCCC2)cn1
InChIInChI=1S/C14H22N2O/c1-11-7-8-12(9-15-11)14(17)10-16-13-5-3-2-4-6-13/h7-9,13-14,16-17H,2-6,10H2,1H3
InChIKeyQPVQHQUJHDTLEU-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.35
Rot. Bonds4

About 2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol

2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol (PubChem CID 56694973) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol
PubChem CID56694973
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol
SMILESCc1ccc(C(O)CNC2CCCCC2)cn1
InChIInChI=1S/C14H22N2O/c1-11-7-8-12(9-15-11)14(17)10-16-13-5-3-2-4-6-13/h7-9,13-14,16-17H,2-6,10H2,1H3
InChIKeyQPVQHQUJHDTLEU-UHFFFAOYSA-N
XLogP2.35
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-2-(cycloheptylamino)-1-(4-methylphenyl)ethanol
CID 39350104
2-(cycloheptylamino)-1-(4-propan-2-ylphenyl)ethanol
CID 60900441
1-(4-chlorophenyl)-2-(cycloheptylamino)ethanol
CID 60724687
2-cyclopentylsulfanyl-1-(6-methyl-3-pyridinyl)ethanol
CID 65139338
(1S)-2-(cyclopentylamino)-1-(3,4-dichlorophenyl)ethanol
CID 94591374
1-cycloheptyl-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
CID 65400041
2-(cyclobutylamino)-1-(4-methoxyphenyl)ethanol
CID 62414370
ethyl 2-(cyclohexylamino)-2-(6-methyl-3-pyridinyl)acetate
CID 104822573
1-(1,3-benzodioxol-5-yl)-2-(cyclooctylamino)ethanol
CID 60896946
(2-methylcyclopentyl)-(6-methyl-3-pyridinyl)methanol
CID 107192253
1-(6-methyl-3-pyridinyl)-2-(thian-4-yl)ethanol
CID 105096815
1-(6-methyl-3-pyridinyl)-2-(oxan-4-yl)ethanol
CID 104823049

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol?
The IUPAC name of 2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol (CID 56694973) is 2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol.
What is the SMILES notation for 2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol?
The canonical SMILES for 2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol is Cc1ccc(C(O)CNC2CCCCC2)cn1.
What is the InChIKey of 2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol?
The InChIKey is QPVQHQUJHDTLEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11-7-8-12(9-15-11)14(17)10-16-13-5-3-2-4-6-13/h7-9,13-14,16-17H,2-6,10H2,1H3.
What are the key properties of 2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol?
2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol has a molecular weight of 234.34 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylamino)-1-(6-methyl-3-pyridinyl)ethanol is sourced from PubChem (CID 56694973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).