[3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol

C19H24N2O2 — CID 171674001

IUPAC[3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol
SMILESCc1cc(CO)cc(-c2ccc(OCCN3CCCC3)nc2)c1
InChIInChI=1S/C19H24N2O2/c1-15-10-16(14-22)12-18(11-15)17-4-5-19(20-13-17)23-9-8-21-6-2-3-7-21/h4-5,10-13,22H,2-3,6-9,14H2,1H3
InChIKeyPRAMQKHLVPVLCH-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.02
Rot. Bonds6

About [3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol

[3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol (PubChem CID 171674001) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is [3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol.

Molecular Properties

Compound Name[3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol
PubChem CID171674001
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name[3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol
SMILESCc1cc(CO)cc(-c2ccc(OCCN3CCCC3)nc2)c1
InChIInChI=1S/C19H24N2O2/c1-15-10-16(14-22)12-18(11-15)17-4-5-19(20-13-17)23-9-8-21-6-2-3-7-21/h4-5,10-13,22H,2-3,6-9,14H2,1H3
InChIKeyPRAMQKHLVPVLCH-UHFFFAOYSA-N
XLogP3.02
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-phenyl-2-(2-piperidin-1-ylethoxy)pyridine
CID 126471382
4-[2-[[5-(4-methylphenyl)-2-pyridinyl]oxy]ethyl]morpholine
CID 126471082
5-tert-butyl-2-(2-pyrrolidin-1-ylethoxy)pyridine
CID 67960770
2-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]-1-benzothiophen-6-ol
CID 56976087
N-[[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62297202
[6-(2-pyrrolidin-1-ylethoxy)pyridazin-3-yl]methanol
CID 61255515
3-bromo-6-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine
CID 118665090
6-(2-pyrrolidin-1-ylethoxy)pyridine-3-carbonitrile
CID 55137110
[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol
CID 10751471
[3,5-dibromo-4-(2-piperidin-1-ylethoxy)phenyl]methanol
CID 107738824
ethane;2-[4-[3-[[5-(hydroxymethyl)-2-pyridinyl]oxy]propyl]piperazin-1-yl]ethanol;propane
CID 142386023
[4-[2-(azepan-1-yl)ethoxy]phenyl]methanol;hydrochloride
CID 78358370

Frequently Asked Questions

What is the IUPAC name of [3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol?
The IUPAC name of [3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol (CID 171674001) is [3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol.
What is the SMILES notation for [3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol?
The canonical SMILES for [3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol is Cc1cc(CO)cc(-c2ccc(OCCN3CCCC3)nc2)c1.
What is the InChIKey of [3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol?
The InChIKey is PRAMQKHLVPVLCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-15-10-16(14-22)12-18(11-15)17-4-5-19(20-13-17)23-9-8-21-6-2-3-7-21/h4-5,10-13,22H,2-3,6-9,14H2,1H3.
What are the key properties of [3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol?
[3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol has a molecular weight of 312.41 g/mol, XLogP of 3.02, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-5-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]phenyl]methanol is sourced from PubChem (CID 171674001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).