[4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol

C15H24N2O — CID 143430195

IUPAC[4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol
SMILESCc1nc(C)c(CO)c(NC2CCCCC2)c1C
InChIInChI=1S/C15H24N2O/c1-10-11(2)16-12(3)14(9-18)15(10)17-13-7-5-4-6-8-13/h13,18H,4-9H2,1-3H3,(H,16,17)
InChIKeyMBTWBXCONXRUMQ-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.24
Rot. Bonds3

About [4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol

[4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol (PubChem CID 143430195) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is [4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol.

Molecular Properties

Compound Name[4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol
PubChem CID143430195
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name[4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol
SMILESCc1nc(C)c(CO)c(NC2CCCCC2)c1C
InChIInChI=1S/C15H24N2O/c1-10-11(2)16-12(3)14(9-18)15(10)17-13-7-5-4-6-8-13/h13,18H,4-9H2,1-3H3,(H,16,17)
InChIKeyMBTWBXCONXRUMQ-UHFFFAOYSA-N
XLogP3.24
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol?
The IUPAC name of [4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol (CID 143430195) is [4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol.
What is the SMILES notation for [4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol?
The canonical SMILES for [4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol is Cc1nc(C)c(CO)c(NC2CCCCC2)c1C.
What is the InChIKey of [4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol?
The InChIKey is MBTWBXCONXRUMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-10-11(2)16-12(3)14(9-18)15(10)17-13-7-5-4-6-8-13/h13,18H,4-9H2,1-3H3,(H,16,17).
What are the key properties of [4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol?
[4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol has a molecular weight of 248.37 g/mol, XLogP of 3.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(cyclohexylamino)-2,5,6-trimethyl-3-pyridinyl]methanol is sourced from PubChem (CID 143430195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).