[3-[ethyl(propyl)amino]-4-pyridinyl]methanol

C11H18N2O — CID 105066699

IUPAC[3-[ethyl(propyl)amino]-4-pyridinyl]methanol
SMILESCCCN(CC)c1cnccc1CO
InChIInChI=1S/C11H18N2O/c1-3-7-13(4-2)11-8-12-6-5-10(11)9-14/h5-6,8,14H,3-4,7,9H2,1-2H3
InChIKeyZJAREKMJKCIOPM-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.81
Rot. Bonds5

About [3-[ethyl(propyl)amino]-4-pyridinyl]methanol

[3-[ethyl(propyl)amino]-4-pyridinyl]methanol (PubChem CID 105066699) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is [3-[ethyl(propyl)amino]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[3-[ethyl(propyl)amino]-4-pyridinyl]methanol
PubChem CID105066699
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name[3-[ethyl(propyl)amino]-4-pyridinyl]methanol
SMILESCCCN(CC)c1cnccc1CO
InChIInChI=1S/C11H18N2O/c1-3-7-13(4-2)11-8-12-6-5-10(11)9-14/h5-6,8,14H,3-4,7,9H2,1-2H3
InChIKeyZJAREKMJKCIOPM-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 [3-[ethyl(propyl)amino]-4-pyridinyl]methanol?
The IUPAC name of [3-[ethyl(propyl)amino]-4-pyridinyl]methanol (CID 105066699) is [3-[ethyl(propyl)amino]-4-pyridinyl]methanol.
What is the SMILES notation for [3-[ethyl(propyl)amino]-4-pyridinyl]methanol?
The canonical SMILES for [3-[ethyl(propyl)amino]-4-pyridinyl]methanol is CCCN(CC)c1cnccc1CO.
What is the InChIKey of [3-[ethyl(propyl)amino]-4-pyridinyl]methanol?
The InChIKey is ZJAREKMJKCIOPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-3-7-13(4-2)11-8-12-6-5-10(11)9-14/h5-6,8,14H,3-4,7,9H2,1-2H3.
What are the key properties of [3-[ethyl(propyl)amino]-4-pyridinyl]methanol?
[3-[ethyl(propyl)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 [3-[ethyl(propyl)amino]-4-pyridinyl]methanol is sourced from PubChem (CID 105066699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).