N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine

C11H18N2O — CID 61373670

IUPACN-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
SMILESCCNCc1cccnc1OC(C)C
InChIInChI=1S/C11H18N2O/c1-4-12-8-10-6-5-7-13-11(10)14-9(2)3/h5-7,9,12H,4,8H2,1-3H3
InChIKeyJSHWUKQGVJZGTG-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.98
Rot. Bonds5

About N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine

N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine (PubChem CID 61373670) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
PubChem CID61373670
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC NameN-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
SMILESCCNCc1cccnc1OC(C)C
InChIInChI=1S/C11H18N2O/c1-4-12-8-10-6-5-7-13-11(10)14-9(2)3/h5-7,9,12H,4,8H2,1-3H3
InChIKeyJSHWUKQGVJZGTG-UHFFFAOYSA-N
XLogP1.98
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propan-1-amine
CID 61373669
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]prop-2-yn-1-amine
CID 62142011
methyl 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]acetate
CID 61375172
N,N-diethyl-2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]acetamide
CID 61374984
3-chloro-2-[[(2-propan-2-yloxy-3-pyridinyl)methylamino]methyl]phenol
CID 78959442
2-(3-methylbutoxy)-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 61483713
N-[(2-methyl-1H-imidazol-5-yl)methyl]-1-(2-propan-2-yloxy-3-pyridinyl)methanamine
CID 62742368
(E)-3-methyl-4-[(2-propan-2-yloxy-3-pyridinyl)methylamino]but-2-enoic acid
CID 103247286
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopropanamine
CID 62290526
N-[2-[[3-(ethylaminomethyl)-2-pyridinyl]oxy]ethyl]-N-propan-2-ylpropan-2-amine
CID 115505728
N-[(6-methoxy-2-pyridinyl)methyl]-1-(2-propan-2-yloxy-3-pyridinyl)methanamine
CID 63984677
3-methoxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]butan-2-amine
CID 115709816

Frequently Asked Questions

What is the IUPAC name of N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine (CID 61373670) is N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine is CCNCc1cccnc1OC(C)C.
What is the InChIKey of N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine?
The InChIKey is JSHWUKQGVJZGTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-4-12-8-10-6-5-7-13-11(10)14-9(2)3/h5-7,9,12H,4,8H2,1-3H3.
What are the key properties of N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine?
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine has a molecular weight of 194.28 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 61373670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).