3-(2-methoxy-3-pyridinyl)propan-1-amine

C9H14N2O — CID 55266989

IUPAC3-(2-methoxy-3-pyridinyl)propan-1-amine
SMILESCOc1ncccc1CCCN
InChIInChI=1S/C9H14N2O/c1-12-9-8(4-2-6-10)5-3-7-11-9/h3,5,7H,2,4,6,10H2,1H3
InChIKeyWRWHDEANNMGMAO-UHFFFAOYSA-N
MW166.22 g/mol
LogP0.98
Rot. Bonds4

About 3-(2-methoxy-3-pyridinyl)propan-1-amine

3-(2-methoxy-3-pyridinyl)propan-1-amine (PubChem CID 55266989) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 3-(2-methoxy-3-pyridinyl)propan-1-amine.

Molecular Properties

Compound Name3-(2-methoxy-3-pyridinyl)propan-1-amine
PubChem CID55266989
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name3-(2-methoxy-3-pyridinyl)propan-1-amine
SMILESCOc1ncccc1CCCN
InChIInChI=1S/C9H14N2O/c1-12-9-8(4-2-6-10)5-3-7-11-9/h3,5,7H,2,4,6,10H2,1H3
InChIKeyWRWHDEANNMGMAO-UHFFFAOYSA-N
XLogP0.98
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

O-[2-(2-methoxy-3-pyridinyl)ethyl]hydroxylamine
CID 70307544
(2-methoxy-3-pyridinyl)methanamine;hydrochloride
CID 71627038
[3-(3-aminopropyl)-2-pyridinyl] acetate
CID 174988941
N'-[(2-methoxy-3-pyridinyl)methyl]propane-1,3-diamine
CID 21271684
2-methoxy-3-(methoxymethyl)pyridine
CID 67266398
N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine
CID 67241279
2-[2-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]ethanamine
CID 114057582
N-[(2-methoxy-3-pyridinyl)methyl]-4-phenylbutan-1-amine
CID 114333213
3-[(2,5-difluorophenyl)methyl]-2-methoxypyridine
CID 168947989
4-[2-(2-methoxy-3-pyridinyl)ethylcarbamoylamino]butanoic acid
CID 122014854
5-chloro-N-[(2-methoxy-3-pyridinyl)methyl]-N-methylpentan-1-amine
CID 107205014
N-[(2-methoxy-3-pyridinyl)methyl]decan-1-amine
CID 63491513

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxy-3-pyridinyl)propan-1-amine?
The IUPAC name of 3-(2-methoxy-3-pyridinyl)propan-1-amine (CID 55266989) is 3-(2-methoxy-3-pyridinyl)propan-1-amine.
What is the SMILES notation for 3-(2-methoxy-3-pyridinyl)propan-1-amine?
The canonical SMILES for 3-(2-methoxy-3-pyridinyl)propan-1-amine is COc1ncccc1CCCN.
What is the InChIKey of 3-(2-methoxy-3-pyridinyl)propan-1-amine?
The InChIKey is WRWHDEANNMGMAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-12-9-8(4-2-6-10)5-3-7-11-9/h3,5,7H,2,4,6,10H2,1H3.
What are the key properties of 3-(2-methoxy-3-pyridinyl)propan-1-amine?
3-(2-methoxy-3-pyridinyl)propan-1-amine has a molecular weight of 166.22 g/mol, XLogP of 0.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxy-3-pyridinyl)propan-1-amine is sourced from PubChem (CID 55266989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).