2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine

C16H20N2O — CID 63069645

IUPAC2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine
SMILESCC(C)(C)NCc1ccc(Oc2cccnc2)cc1
InChIInChI=1S/C16H20N2O/c1-16(2,3)18-11-13-6-8-14(9-7-13)19-15-5-4-10-17-12-15/h4-10,12,18H,11H2,1-3H3
InChIKeyCEXOVNQODQVAOE-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.76
Rot. Bonds4

About 2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine

2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine (PubChem CID 63069645) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine
PubChem CID63069645
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine
SMILESCC(C)(C)NCc1ccc(Oc2cccnc2)cc1
InChIInChI=1S/C16H20N2O/c1-16(2,3)18-11-13-6-8-14(9-7-13)19-15-5-4-10-17-12-15/h4-10,12,18H,11H2,1-3H3
InChIKeyCEXOVNQODQVAOE-UHFFFAOYSA-N
XLogP3.76
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine
CID 159685342
2-methyl-N-[(4-pyridin-2-yloxyphenyl)methyl]propan-2-amine
CID 71120055
N-[[4-(3-iodophenoxy)phenyl]methyl]-2-methylpropan-2-amine
CID 63553320
N-[[4-(3,5-dichlorophenoxy)phenyl]methyl]-2-methylpropan-2-amine
CID 63550550
N-[[4-[(tert-butylamino)methyl]phenyl]methyl]-2-methylpropan-2-amine
CID 22251747
2-(4-pyridin-3-yloxyphenyl)ethanamine
CID 63815033
2-methyl-N-[[4-[(6-methyl-3-pyridinyl)oxymethyl]phenyl]methyl]propan-2-amine
CID 62440308
2-methyl-N-[[6-(pyridin-3-yloxymethyl)-2-pyridinyl]methyl]propan-2-amine
CID 106907868
N,N-dimethyl-3-(4-pyridin-3-yloxyphenyl)propan-1-amine
CID 170865971
N-[[4-(2,3-dimethylphenoxy)phenyl]methyl]-2-methylpropan-2-amine
CID 63551807
N-[[4-(3-fluoropropoxy)phenyl]methyl]-2-methylpropan-2-amine
CID 81106411
methyl 2-amino-3-(4-pyridin-3-yloxyphenyl)propanoate
CID 24730209

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine (CID 63069645) is 2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine is CC(C)(C)NCc1ccc(Oc2cccnc2)cc1.
What is the InChIKey of 2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine?
The InChIKey is CEXOVNQODQVAOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-16(2,3)18-11-13-6-8-14(9-7-13)19-15-5-4-10-17-12-15/h4-10,12,18H,11H2,1-3H3.
What are the key properties of 2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine?
2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine has a molecular weight of 256.35 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(4-pyridin-3-yloxyphenyl)methyl]propan-2-amine is sourced from PubChem (CID 63069645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).