N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine

C15H25N3O — CID 79150803

IUPACN-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine
SMILESCNCc1nc(C)ccc1OCCCN1CCCC1
InChIInChI=1S/C15H25N3O/c1-13-6-7-15(14(17-13)12-16-2)19-11-5-10-18-8-3-4-9-18/h6-7,16H,3-5,8-12H2,1-2H3
InChIKeyNKNPKYKRKHGPAV-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.97
Rot. Bonds7

About N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine

N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine (PubChem CID 79150803) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine
PubChem CID79150803
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine
SMILESCNCc1nc(C)ccc1OCCCN1CCCC1
InChIInChI=1S/C15H25N3O/c1-13-6-7-15(14(17-13)12-16-2)19-11-5-10-18-8-3-4-9-18/h6-7,16H,3-5,8-12H2,1-2H3
InChIKeyNKNPKYKRKHGPAV-UHFFFAOYSA-N
XLogP1.97
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methyl]ethanamine
CID 79151286
1-[6-methyl-3-(2-piperidin-1-ylethoxy)-2-pyridinyl]propan-2-amine
CID 79169001
1-[2-[[6-methyl-2-(methylaminomethyl)-3-pyridinyl]oxy]ethyl]imidazolidin-2-one
CID 79151657
1-[3-fluoro-4-(3-pyrrolidin-1-ylpropoxy)phenyl]-N-methylmethanamine
CID 107686584
1-[5-methoxy-2-(3-pyrrolidin-1-ylpropoxy)phenyl]-N-methylmethanamine
CID 61493815
N-methyl-1-[6-methyl-3-[2-(2-methylpropoxy)ethoxy]-2-pyridinyl]methanamine
CID 106450396
1-[3-chloro-6-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]-N-methylmethanamine
CID 62297186
1-(3-but-2-ynoxy-6-methyl-2-pyridinyl)-N-methylmethanamine
CID 79151354
N-methyl-1-[6-methyl-3-(pyrimidin-2-ylmethoxy)-2-pyridinyl]methanamine
CID 79150580
1-[3-[(4-ethylmorpholin-2-yl)methoxy]-6-methyl-2-pyridinyl]-N-methylmethanamine
CID 79167041
N-methyl-1-[5-nitro-2-(3-pyrrolidin-1-ylpropoxy)phenyl]methanamine
CID 61493931
2-methyl-5-(3-pyrrolidin-1-ylpropoxy)pyridine
CID 129451930

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine?
The IUPAC name of N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine (CID 79150803) is N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine.
What is the SMILES notation for N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine?
The canonical SMILES for N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine is CNCc1nc(C)ccc1OCCCN1CCCC1.
What is the InChIKey of N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine?
The InChIKey is NKNPKYKRKHGPAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-13-6-7-15(14(17-13)12-16-2)19-11-5-10-18-8-3-4-9-18/h6-7,16H,3-5,8-12H2,1-2H3.
What are the key properties of N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine?
N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine has a molecular weight of 263.38 g/mol, XLogP of 1.97, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[6-methyl-3-(3-pyrrolidin-1-ylpropoxy)-2-pyridinyl]methanamine is sourced from PubChem (CID 79150803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).