2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine

C15H26N2O — CID 62290152

IUPAC2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine
SMILESCC(C)CCOc1ncccc1CNC(C)(C)C
InChIInChI=1S/C15H26N2O/c1-12(2)8-10-18-14-13(7-6-9-16-14)11-17-15(3,4)5/h6-7,9,12,17H,8,10-11H2,1-5H3
InChIKeyIFHPEPCYLAQLGP-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.39
Rot. Bonds6

About 2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine

2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine (PubChem CID 62290152) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine
PubChem CID62290152
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine
SMILESCC(C)CCOc1ncccc1CNC(C)(C)C
InChIInChI=1S/C15H26N2O/c1-12(2)8-10-18-14-13(7-6-9-16-14)11-17-15(3,4)5/h6-7,9,12,17H,8,10-11H2,1-5H3
InChIKeyIFHPEPCYLAQLGP-UHFFFAOYSA-N
XLogP3.39
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-1-amine
CID 62290330
N-[[2-(2-methoxyethoxy)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62289999
N-[[2-(3-methoxypropoxy)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62288771
N-[(2-ethoxy-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62290832
N-[[2-(2-ethoxyethoxy)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62291566
N-methyl-1-[2-(4-methylpentoxy)-3-pyridinyl]methanamine
CID 62292560
N-[[3-methoxy-2-(3-methylbutoxy)phenyl]methyl]-2-methylpropan-2-amine
CID 54847891
[2-(4-methylpentoxy)-3-pyridinyl]methanamine
CID 28994806
N-[[2-(3,3-dimethylbutoxy)-3-pyridinyl]methyl]ethanamine
CID 66226371
2-(3-methylbutoxy)-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 61483713
N-[(2-cycloheptyloxy-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62297718
2-methyl-N-[[2-[(6-methyl-3-pyridinyl)oxy]-3-pyridinyl]methyl]propan-2-amine
CID 62287354

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine (CID 62290152) is 2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine is CC(C)CCOc1ncccc1CNC(C)(C)C.
What is the InChIKey of 2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine?
The InChIKey is IFHPEPCYLAQLGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-12(2)8-10-18-14-13(7-6-9-16-14)11-17-15(3,4)5/h6-7,9,12,17H,8,10-11H2,1-5H3.
What are the key properties of 2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine?
2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine has a molecular weight of 250.39 g/mol, XLogP of 3.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 62290152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).