ethane;(4-ethyl-3-pyridinyl)methanol;propane

C15H31NO — CID 142370025

IUPACethane;(4-ethyl-3-pyridinyl)methanol;propane
SMILESCC.CC.CCC.CCc1ccncc1CO
InChIInChI=1S/C8H11NO.C3H8.2C2H6/c1-2-7-3-4-9-5-8(7)6-10;1-3-2;2*1-2/h3-5,10H,2,6H2,1H3;3H2,1-2H3;2*1-2H3
InChIKeyMIYUTVZSGULOEJ-UHFFFAOYSA-N
MW241.42 g/mol
LogP4.61
Rot. Bonds2

About ethane;(4-ethyl-3-pyridinyl)methanol;propane

ethane;(4-ethyl-3-pyridinyl)methanol;propane (PubChem CID 142370025) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is ethane;(4-ethyl-3-pyridinyl)methanol;propane.

Molecular Properties

Compound Nameethane;(4-ethyl-3-pyridinyl)methanol;propane
PubChem CID142370025
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Nameethane;(4-ethyl-3-pyridinyl)methanol;propane
SMILESCC.CC.CCC.CCc1ccncc1CO
InChIInChI=1S/C8H11NO.C3H8.2C2H6/c1-2-7-3-4-9-5-8(7)6-10;1-3-2;2*1-2/h3-5,10H,2,6H2,1H3;3H2,1-2H3;2*1-2H3
InChIKeyMIYUTVZSGULOEJ-UHFFFAOYSA-N
XLogP4.61
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze ethane;(4-ethyl-3-pyridinyl)methanol;propane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4-diethylpyridine;ethane
CID 90914060
[4-(bromomethyl)-3-pyridinyl]methanol
CID 139484815
(4-butyl-3-pyridinyl)methanol
CID 173058896
1-(4-ethyl-3-pyridinyl)propan-2-one
CID 83826723
[3-(diethylamino)-4-pyridinyl]methanol
CID 105066644
1-amino-1-[3-(hydroxymethyl)-4-pyridinyl]propan-2-one
CID 130039547
ethyl 4-(hydroxymethyl)pyridine-3-carboxylate
CID 112757154
3-bromo-4-ethylpyridine
CID 13160533
(4-iodo-3-pyridinyl)methanol
CID 119092620
3-(hydroxymethyl)pyridine-4-carboxylic acid
CID 12758257
[4-(methylamino)-3-pyridinyl]methanol
CID 105427975
1-(3-ethyl-4-pyridinyl)ethanone
CID 14863277

Frequently Asked Questions

What is the IUPAC name of ethane;(4-ethyl-3-pyridinyl)methanol;propane?
The IUPAC name of ethane;(4-ethyl-3-pyridinyl)methanol;propane (CID 142370025) is ethane;(4-ethyl-3-pyridinyl)methanol;propane.
What is the SMILES notation for ethane;(4-ethyl-3-pyridinyl)methanol;propane?
The canonical SMILES for ethane;(4-ethyl-3-pyridinyl)methanol;propane is CC.CC.CCC.CCc1ccncc1CO.
What is the InChIKey of ethane;(4-ethyl-3-pyridinyl)methanol;propane?
The InChIKey is MIYUTVZSGULOEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO.C3H8.2C2H6/c1-2-7-3-4-9-5-8(7)6-10;1-3-2;2*1-2/h3-5,10H,2,6H2,1H3;3H2,1-2H3;2*1-2H3.
What are the key properties of ethane;(4-ethyl-3-pyridinyl)methanol;propane?
ethane;(4-ethyl-3-pyridinyl)methanol;propane has a molecular weight of 241.42 g/mol, XLogP of 4.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(4-ethyl-3-pyridinyl)methanol;propane is sourced from PubChem (CID 142370025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).