4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine

C11H16N2O — CID 130559478

IUPAC4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine
SMILESCOc1ccncc1CN1CCCC1
InChIInChI=1S/C11H16N2O/c1-14-11-4-5-12-8-10(11)9-13-6-2-3-7-13/h4-5,8H,2-3,6-7,9H2,1H3
InChIKeyGSCXCQOFKJZMSY-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.69
Rot. Bonds3

About 4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine

4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine (PubChem CID 130559478) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine.

Molecular Properties

Compound Name4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine
PubChem CID130559478
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine
SMILESCOc1ccncc1CN1CCCC1
InChIInChI=1S/C11H16N2O/c1-14-11-4-5-12-8-10(11)9-13-6-2-3-7-13/h4-5,8H,2-3,6-7,9H2,1H3
InChIKeyGSCXCQOFKJZMSY-UHFFFAOYSA-N
XLogP1.69
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

O-[3-[(4-ethylpiperazin-1-yl)methyl]-4-pyridinyl]hydroxylamine
CID 143961834
3-(iodomethyl)-4-methoxypyridine
CID 130559780
N-propan-2-yl-1-[(4-propan-2-yloxy-3-pyridinyl)methyl]piperidin-4-amine
CID 67429738
4-(azepan-1-ylmethyl)pyridin-3-amine
CID 117212629
4-methoxy-3-piperidin-1-ylpyridine
CID 152705375
ethane;4-methoxy-3-propylpyridine
CID 176962232
1-[(2,3,4-trimethoxyphenyl)methyl]azepane
CID 23736534
(1S)-N-[[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]methyl]-N-methyl-1-pyridin-3-ylethanamine
CID 99928863
N-[[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]methyl]-N-methyl-1-pyridin-3-ylethanamine
CID 77081354
1-[(4-methyl-3-pyridinyl)methyl]piperazine
CID 79002283
1-[(5-bromo-2-methoxyphenyl)methyl]azetidine
CID 130159732
3-[2-methoxy-5-(pyrrolidin-1-ylmethyl)phenoxy]pyridine
CID 56722412

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine?
The IUPAC name of 4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine (CID 130559478) is 4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine.
What is the SMILES notation for 4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine?
The canonical SMILES for 4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine is COc1ccncc1CN1CCCC1.
What is the InChIKey of 4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine?
The InChIKey is GSCXCQOFKJZMSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-14-11-4-5-12-8-10(11)9-13-6-2-3-7-13/h4-5,8H,2-3,6-7,9H2,1H3.
What are the key properties of 4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine?
4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine has a molecular weight of 192.26 g/mol, XLogP of 1.69, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-(pyrrolidin-1-ylmethyl)pyridine is sourced from PubChem (CID 130559478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).