N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine

C12H20N2O — CID 79573917

IUPACN-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine
SMILESCNC(COC(C)C)Cc1ccncc1
InChIInChI=1S/C12H20N2O/c1-10(2)15-9-12(13-3)8-11-4-6-14-7-5-11/h4-7,10,12-13H,8-9H2,1-3H3
InChIKeyLEWPGBCXHBOVEQ-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.64
Rot. Bonds6

About N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine

N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine (PubChem CID 79573917) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine.

Molecular Properties

Compound NameN-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine
PubChem CID79573917
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC NameN-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine
SMILESCNC(COC(C)C)Cc1ccncc1
InChIInChI=1S/C12H20N2O/c1-10(2)15-9-12(13-3)8-11-4-6-14-7-5-11/h4-7,10,12-13H,8-9H2,1-3H3
InChIKeyLEWPGBCXHBOVEQ-UHFFFAOYSA-N
XLogP1.64
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-ethylphenyl)-N-methyl-3-propan-2-yloxypropan-2-amine
CID 105101340
N-methyl-1-propan-2-yloxy-3-[4-(trifluoromethyl)phenyl]propan-2-amine
CID 105013128
1-(4-chlorophenyl)-N-methyl-3-pyridin-4-ylpropan-2-amine
CID 62553099
1-(4-fluorophenyl)-N-methyl-3-pyridin-4-ylpropan-2-amine
CID 62553272
4-(propan-2-yloxymethyl)pyridine
CID 14442204
N-methyl-1-pyridin-4-ylhex-4-yn-2-amine
CID 62551577
1-(3-bromo-4-fluorophenyl)-N-methyl-3-propan-2-yloxypropan-2-amine
CID 105111283
1-(2,6-dichlorophenyl)-N-methyl-3-propan-2-yloxypropan-2-amine
CID 79574139
N-methyl-1-pyridin-4-yldecan-2-amine
CID 62605644
3-ethoxy-N-methyl-1-pyridin-4-ylpentan-2-amine
CID 116716532
1-(1,3-dioxolan-2-yl)-N-methyl-3-pyridin-4-ylpropan-2-amine
CID 103546894
N-methyl-1,5-dipyridin-4-ylpentan-3-amine
CID 11253852

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine?
The IUPAC name of N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine (CID 79573917) is N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine.
What is the SMILES notation for N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine?
The canonical SMILES for N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine is CNC(COC(C)C)Cc1ccncc1.
What is the InChIKey of N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine?
The InChIKey is LEWPGBCXHBOVEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-10(2)15-9-12(13-3)8-11-4-6-14-7-5-11/h4-7,10,12-13H,8-9H2,1-3H3.
What are the key properties of N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine?
N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine has a molecular weight of 208.31 g/mol, XLogP of 1.64, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine is sourced from PubChem (CID 79573917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).