3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine

C13H21N3O — CID 103987393

IUPAC3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine
SMILESCCNC(CC1CCOC1)c1cnccc1N
InChIInChI=1S/C13H21N3O/c1-2-16-13(7-10-4-6-17-9-10)11-8-15-5-3-12(11)14/h3,5,8,10,13,16H,2,4,6-7,9H2,1H3,(H2,14,15)
InChIKeyMABWZDCVDVXLLT-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.74
Rot. Bonds5

About 3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine

3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine (PubChem CID 103987393) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine.

Molecular Properties

Compound Name3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine
PubChem CID103987393
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine
SMILESCCNC(CC1CCOC1)c1cnccc1N
InChIInChI=1S/C13H21N3O/c1-2-16-13(7-10-4-6-17-9-10)11-8-15-5-3-12(11)14/h3,5,8,10,13,16H,2,4,6-7,9H2,1H3,(H2,14,15)
InChIKeyMABWZDCVDVXLLT-UHFFFAOYSA-N
XLogP1.74
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine
CID 103987130
N-ethyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine
CID 103987178
N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine
CID 105065449
3-[1-(ethylamino)but-3-enyl]pyridin-4-amine
CID 116660865
1-(4-amino-3-pyridinyl)-3-(oxolan-3-yl)propan-2-ol
CID 103986436
N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine
CID 103986918
1-(4-amino-3-pyridinyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine
CID 79092538
1-(4-chlorophenyl)-N-ethyl-2-(oxolan-3-yl)ethanamine
CID 103987271
N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine
CID 103987345
1-(2,5-dimethoxyphenyl)-N-ethyl-2-(oxolan-3-yl)ethanamine
CID 103987375
N-ethyl-2-(oxan-4-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126820
N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine
CID 103986939

Frequently Asked Questions

What is the IUPAC name of 3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine?
The IUPAC name of 3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine (CID 103987393) is 3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine.
What is the SMILES notation for 3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine?
The canonical SMILES for 3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine is CCNC(CC1CCOC1)c1cnccc1N.
What is the InChIKey of 3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine?
The InChIKey is MABWZDCVDVXLLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-2-16-13(7-10-4-6-17-9-10)11-8-15-5-3-12(11)14/h3,5,8,10,13,16H,2,4,6-7,9H2,1H3,(H2,14,15).
What are the key properties of 3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine?
3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine has a molecular weight of 235.33 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine is sourced from PubChem (CID 103987393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).