1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine

C10H15BrN2O — CID 62291153

IUPAC1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine
SMILESCCCOc1ncc(Br)cc1CNC
InChIInChI=1S/C10H15BrN2O/c1-3-4-14-10-8(6-12-2)5-9(11)7-13-10/h5,7,12H,3-4,6H2,1-2H3
InChIKeyFAFVIURPPOMOAL-UHFFFAOYSA-N
MW259.15 g/mol
LogP2.35
Rot. Bonds5

About 1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine

1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine (PubChem CID 62291153) has the molecular formula C10H15BrN2O and a molecular weight of 259.15 g/mol. Its IUPAC name is 1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine
PubChem CID62291153
Molecular FormulaC10H15BrN2O
Molecular Weight259.15 g/mol
Exact Mass258.04
IUPAC Name1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine
SMILESCCCOc1ncc(Br)cc1CNC
InChIInChI=1S/C10H15BrN2O/c1-3-4-14-10-8(6-12-2)5-9(11)7-13-10/h5,7,12H,3-4,6H2,1-2H3
InChIKeyFAFVIURPPOMOAL-UHFFFAOYSA-N
XLogP2.35
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.15
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-bromo-2-methoxy-3-pyridinyl)-N-methylmethanamine
CID 62292466
1-[5-bromo-2-(2-methylpropoxy)-3-pyridinyl]-N-methylmethanamine
CID 62290504
1-[5-bromo-2-(cyclopropylmethoxy)-3-pyridinyl]-N-methylmethanamine
CID 62291519
N-[(5-bromo-2-pentoxy-3-pyridinyl)methyl]cyclopropanamine
CID 55058832
1-[5-bromo-2-(3-ethylphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 62297750
N-[(5-bromo-2-ethoxy-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62291381
1-[5-bromo-2-(3-bromo-5-fluorophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 81325924
1-[5-bromo-2-(3,5-dimethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine
CID 64730620
1-[5-bromo-2-(4-chloro-3,5-dimethylphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 62322244
5-bromo-3-(methylaminomethyl)-N,N-dipropylpyridin-2-amine
CID 55054995
1-[5-bromo-2-(4,4-dimethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine
CID 114342262
1-[5-bromo-2-(3-fluorophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 55058269

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine?
The IUPAC name of 1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine (CID 62291153) is 1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine?
The canonical SMILES for 1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine is CCCOc1ncc(Br)cc1CNC.
What is the InChIKey of 1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine?
The InChIKey is FAFVIURPPOMOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN2O/c1-3-4-14-10-8(6-12-2)5-9(11)7-13-10/h5,7,12H,3-4,6H2,1-2H3.
What are the key properties of 1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine?
1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine has a molecular weight of 259.15 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-propoxy-3-pyridinyl)-N-methylmethanamine is sourced from PubChem (CID 62291153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).