N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide

C14H20N2O2 — CID 74232622

IUPACN-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCC(O)CC2)cc(C)n1
InChIInChI=1S/C14H20N2O2/c1-9-7-11(8-10(2)15-9)14(18)16-12-3-5-13(17)6-4-12/h7-8,12-13,17H,3-6H2,1-2H3,(H,16,18)
InChIKeyDVKCLMQCJRZDDZ-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.73
Rot. Bonds2

About N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide

N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide (PubChem CID 74232622) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide
PubChem CID74232622
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCC(O)CC2)cc(C)n1
InChIInChI=1S/C14H20N2O2/c1-9-7-11(8-10(2)15-9)14(18)16-12-3-5-13(17)6-4-12/h7-8,12-13,17H,3-6H2,1-2H3,(H,16,18)
InChIKeyDVKCLMQCJRZDDZ-UHFFFAOYSA-N
XLogP1.73
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide (CID 74232622) is N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide is Cc1cc(C(=O)NC2CCC(O)CC2)cc(C)n1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide?
The InChIKey is DVKCLMQCJRZDDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-9-7-11(8-10(2)15-9)14(18)16-12-3-5-13(17)6-4-12/h7-8,12-13,17H,3-6H2,1-2H3,(H,16,18).
What are the key properties of N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide?
N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.73, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-2,6-dimethylpyridine-4-carboxamide is sourced from PubChem (CID 74232622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).