2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine

C15H26N2O — CID 79794003

IUPAC2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine
SMILESCC(C)CCOc1ccc(CNC(C)(C)C)nc1
InChIInChI=1S/C15H26N2O/c1-12(2)8-9-18-14-7-6-13(16-11-14)10-17-15(3,4)5/h6-7,11-12,17H,8-10H2,1-5H3
InChIKeyYJOWLKRBHSEFLT-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.39
Rot. Bonds6

About 2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine

2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine (PubChem CID 79794003) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine
PubChem CID79794003
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine
SMILESCC(C)CCOc1ccc(CNC(C)(C)C)nc1
InChIInChI=1S/C15H26N2O/c1-12(2)8-9-18-14-7-6-13(16-11-14)10-17-15(3,4)5/h6-7,11-12,17H,8-10H2,1-5H3
InChIKeyYJOWLKRBHSEFLT-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

Analyze 2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[5-(4-methoxybutoxy)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 104647123
N-[(5-but-3-ynoxy-2-pyridinyl)methyl]-2-methylpropan-2-amine
CID 79794973
N-[[5-(3-ethylsulfonylpropoxy)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 79788512
1-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-2,3-dimethylbutan-2-ol
CID 114492176
N-[[5-(2-ethylbutoxy)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 82927537
2-methyl-N-[[5-(2-thiophen-2-ylethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 79794362
4-[[6-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]butan-2-ol
CID 113398862
3-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N-ethylpropanamide
CID 79784063
3-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxymethyl]pentan-3-ol
CID 114492175
N-[[5-(2-chloroprop-2-enoxy)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 79784061
N-[[5-(3,3-dimethylbutoxy)-2-pyridinyl]methyl]propan-2-amine
CID 79784006
2-methyl-N-[[5-[2-(2-methylpyrazol-3-yl)ethoxy]-2-pyridinyl]methyl]propan-2-amine
CID 102999863

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine (CID 79794003) is 2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine is CC(C)CCOc1ccc(CNC(C)(C)C)nc1.
What is the InChIKey of 2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine?
The InChIKey is YJOWLKRBHSEFLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-12(2)8-9-18-14-7-6-13(16-11-14)10-17-15(3,4)5/h6-7,11-12,17H,8-10H2,1-5H3.
What are the key properties of 2-methyl-N-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine?
2-methyl-N-[[5-(3-methylbutoxy)-2-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-[[5-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 79794003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).