4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol

C16H26N2O — CID 123159243

IUPAC4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol
SMILESCCN(CC)C1CCC(O)(c2ccc(C)nc2)CC1
InChIInChI=1S/C16H26N2O/c1-4-18(5-2)15-8-10-16(19,11-9-15)14-7-6-13(3)17-12-14/h6-7,12,15,19H,4-5,8-11H2,1-3H3
InChIKeyDANZTYRZDMVFRN-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.86
Rot. Bonds4

About 4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol

4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol (PubChem CID 123159243) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol
PubChem CID123159243
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol
SMILESCCN(CC)C1CCC(O)(c2ccc(C)nc2)CC1
InChIInChI=1S/C16H26N2O/c1-4-18(5-2)15-8-10-16(19,11-9-15)14-7-6-13(3)17-12-14/h6-7,12,15,19H,4-5,8-11H2,1-3H3
InChIKeyDANZTYRZDMVFRN-UHFFFAOYSA-N
XLogP2.86
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol?
The IUPAC name of 4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol (CID 123159243) is 4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol.
What is the SMILES notation for 4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol?
The canonical SMILES for 4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol is CCN(CC)C1CCC(O)(c2ccc(C)nc2)CC1.
What is the InChIKey of 4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol?
The InChIKey is DANZTYRZDMVFRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-4-18(5-2)15-8-10-16(19,11-9-15)14-7-6-13(3)17-12-14/h6-7,12,15,19H,4-5,8-11H2,1-3H3.
What are the key properties of 4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol?
4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol has a molecular weight of 262.40 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylamino)-1-(6-methyl-3-pyridinyl)cyclohexan-1-ol is sourced from PubChem (CID 123159243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).