5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine

C13H23N3O — CID 104536911

IUPAC5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine
SMILESCCNc1cncc(OCC(C)(C)N(C)C)c1
InChIInChI=1S/C13H23N3O/c1-6-15-11-7-12(9-14-8-11)17-10-13(2,3)16(4)5/h7-9,15H,6,10H2,1-5H3
InChIKeyZZOGSZKFABHZEZ-UHFFFAOYSA-N
MW237.35 g/mol
LogP2.23
Rot. Bonds6

About 5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine

5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine (PubChem CID 104536911) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine.

Molecular Properties

Compound Name5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine
PubChem CID104536911
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine
SMILESCCNc1cncc(OCC(C)(C)N(C)C)c1
InChIInChI=1S/C13H23N3O/c1-6-15-11-7-12(9-14-8-11)17-10-13(2,3)16(4)5/h7-9,15H,6,10H2,1-5H3
InChIKeyZZOGSZKFABHZEZ-UHFFFAOYSA-N
XLogP2.23
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-5-octoxypyridin-3-amine
CID 113424296
N-ethyl-5-(3-methylbut-3-enoxy)pyridin-3-amine
CID 114471243
N-ethyl-5-(2-phenoxyethoxy)pyridin-3-amine
CID 104536114
N-ethyl-5-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine
CID 106451443
5-[(4-chlorophenyl)methoxy]-N-ethylpyridin-3-amine
CID 104536863
N-ethyl-5-(4-methylphenoxy)pyridin-3-amine
CID 104536266
3-N-ethyl-5-N-(4-methoxyphenyl)-5-N-methylpyridine-3,5-diamine
CID 104534077
5-butoxy-N-propylpyridin-3-amine
CID 104536219
3-N-ethyl-5-N-methyl-5-N-phenylpyridine-3,5-diamine
CID 104532448
N-ethyl-5-quinolin-3-yloxypyridin-3-amine
CID 107388436
N-ethyl-5-(2-iodophenoxy)pyridin-3-amine
CID 104536566
5-(2-bromophenoxy)-N-ethylpyridin-3-amine
CID 104536174

Frequently Asked Questions

What is the IUPAC name of 5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine?
The IUPAC name of 5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine (CID 104536911) is 5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine.
What is the SMILES notation for 5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine?
The canonical SMILES for 5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine is CCNc1cncc(OCC(C)(C)N(C)C)c1.
What is the InChIKey of 5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine?
The InChIKey is ZZOGSZKFABHZEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-6-15-11-7-12(9-14-8-11)17-10-13(2,3)16(4)5/h7-9,15H,6,10H2,1-5H3.
What are the key properties of 5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine?
5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine has a molecular weight of 237.35 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(dimethylamino)-2-methylpropoxy]-N-ethylpyridin-3-amine is sourced from PubChem (CID 104536911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).