2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine

C16H26N2O2 — CID 81250387

IUPAC2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
SMILESCC(C)(C)NCc1cnccc1OCC1CCOCC1
InChIInChI=1S/C16H26N2O2/c1-16(2,3)18-11-14-10-17-7-4-15(14)20-12-13-5-8-19-9-6-13/h4,7,10,13,18H,5-6,8-9,11-12H2,1-3H3
InChIKeyUCZMUPQZHRNMJR-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.78
Rot. Bonds5

About 2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine

2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine (PubChem CID 81250387) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
PubChem CID81250387
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
SMILESCC(C)(C)NCc1cnccc1OCC1CCOCC1
InChIInChI=1S/C16H26N2O2/c1-16(2,3)18-11-14-10-17-7-4-15(14)20-12-13-5-8-19-9-6-13/h4,7,10,13,18H,5-6,8-9,11-12H2,1-3H3
InChIKeyUCZMUPQZHRNMJR-UHFFFAOYSA-N
XLogP2.78
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine with MolForge

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Related Compounds

2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-1-amine
CID 81250243
2-methyl-N-[[4-(oxolan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
CID 81254995
N-[[5-bromo-2-(oxan-4-ylmethoxy)phenyl]methyl]-2-methylpropan-2-amine
CID 63058191
2-methyl-N-[(4-propoxy-3-pyridinyl)methyl]propan-2-amine
CID 81255020
2-methyl-N-[[4-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 62386548
1-[[3-[(tert-butylamino)methyl]-4-pyridinyl]oxy]-N,N,2-trimethylpropan-2-amine
CID 81250486
N-[[2-(cyclopropylmethoxy)-5-fluorophenyl]methyl]-2-methylpropan-2-amine
CID 107696527
N-[[4-[3-(2-methoxyethoxy)propoxy]-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 103405855
2-methyl-N-[[4-(3-methylbutan-2-yloxy)-3-pyridinyl]methyl]propan-2-amine
CID 81251051
3-[(tert-butylamino)methyl]-N-methyl-N-(oxolan-3-yl)pyridin-4-amine
CID 82754061
N-[[4-(cyclohexylmethoxy)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 81253547
N-[[4-(oxan-4-yloxy)-3-pyridinyl]methyl]propan-2-amine
CID 81254203

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine (CID 81250387) is 2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine is CC(C)(C)NCc1cnccc1OCC1CCOCC1.
What is the InChIKey of 2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
The InChIKey is UCZMUPQZHRNMJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-16(2,3)18-11-14-10-17-7-4-15(14)20-12-13-5-8-19-9-6-13/h4,7,10,13,18H,5-6,8-9,11-12H2,1-3H3.
What are the key properties of 2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine has a molecular weight of 278.40 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[4-(oxan-4-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 81250387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).