[2-[butyl(methyl)amino]-4-pyridinyl]methanol

C11H18N2O — CID 61254738

IUPAC[2-[butyl(methyl)amino]-4-pyridinyl]methanol
SMILESCCCCN(C)c1cc(CO)ccn1
InChIInChI=1S/C11H18N2O/c1-3-4-7-13(2)11-8-10(9-14)5-6-12-11/h5-6,8,14H,3-4,7,9H2,1-2H3
InChIKeyQZGDYVKMQKSOIV-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.81
Rot. Bonds5

About [2-[butyl(methyl)amino]-4-pyridinyl]methanol

[2-[butyl(methyl)amino]-4-pyridinyl]methanol (PubChem CID 61254738) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is [2-[butyl(methyl)amino]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[butyl(methyl)amino]-4-pyridinyl]methanol
PubChem CID61254738
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name[2-[butyl(methyl)amino]-4-pyridinyl]methanol
SMILESCCCCN(C)c1cc(CO)ccn1
InChIInChI=1S/C11H18N2O/c1-3-4-7-13(2)11-8-10(9-14)5-6-12-11/h5-6,8,14H,3-4,7,9H2,1-2H3
InChIKeyQZGDYVKMQKSOIV-UHFFFAOYSA-N
XLogP1.81
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-[butyl(methyl)amino]-4-pyridinyl]methanol?
The IUPAC name of [2-[butyl(methyl)amino]-4-pyridinyl]methanol (CID 61254738) is [2-[butyl(methyl)amino]-4-pyridinyl]methanol.
What is the SMILES notation for [2-[butyl(methyl)amino]-4-pyridinyl]methanol?
The canonical SMILES for [2-[butyl(methyl)amino]-4-pyridinyl]methanol is CCCCN(C)c1cc(CO)ccn1.
What is the InChIKey of [2-[butyl(methyl)amino]-4-pyridinyl]methanol?
The InChIKey is QZGDYVKMQKSOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-3-4-7-13(2)11-8-10(9-14)5-6-12-11/h5-6,8,14H,3-4,7,9H2,1-2H3.
What are the key properties of [2-[butyl(methyl)amino]-4-pyridinyl]methanol?
[2-[butyl(methyl)amino]-4-pyridinyl]methanol has a molecular weight of 194.28 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[butyl(methyl)amino]-4-pyridinyl]methanol is sourced from PubChem (CID 61254738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).