1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine

C13H20N2O — CID 104736660

IUPAC1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine
SMILESCC1(C(N)Cc2cccnc2)CCCCO1
InChIInChI=1S/C13H20N2O/c1-13(6-2-3-8-16-13)12(14)9-11-5-4-7-15-10-11/h4-5,7,10,12H,2-3,6,8-9,14H2,1H3
InChIKeySJKBOEQEKZCUFQ-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.91
Rot. Bonds3

About 1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine

1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine (PubChem CID 104736660) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine
PubChem CID104736660
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine
SMILESCC1(C(N)Cc2cccnc2)CCCCO1
InChIInChI=1S/C13H20N2O/c1-13(6-2-3-8-16-13)12(14)9-11-5-4-7-15-10-11/h4-5,7,10,12H,2-3,6,8-9,14H2,1H3
InChIKeySJKBOEQEKZCUFQ-UHFFFAOYSA-N
XLogP1.91
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-methyloxolan-2-yl)-2-pyridin-3-ylethyl]propan-1-amine
CID 104736619
1-(2-methyloxan-2-yl)-2-(4-propan-2-ylphenyl)ethanamine
CID 80683608
1-(2-methylthiolan-2-yl)-2-pyridin-3-ylethanamine
CID 105179943
1-(1-hydroxy-2-pyridin-3-ylethyl)cyclohexan-1-ol
CID 103451724
1-(1-amino-2-pyridin-3-ylethyl)-N,N,4-trimethylcyclohexan-1-amine
CID 104736535
(2S)-1-pyridin-3-ylbutan-2-amine
CID 93246137
(2-methyloxan-2-yl)-[3-(2-methylpropyl)phenyl]methanamine
CID 116544912
(2S)-4-methyl-1-pyridin-3-ylpentan-2-amine
CID 94470637
1-cyclopentyl-2-pyridin-3-ylethanamine
CID 62553066
[1-(1-morpholin-4-ylcyclopentyl)-2-pyridin-3-ylethyl]hydrazine
CID 105243093
1-(oxolan-2-yl)-3-pyridin-3-ylpropan-2-amine
CID 62604735
[1-(1-phenylcyclopentyl)-2-pyridin-3-ylethyl]hydrazine
CID 105217477

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine?
The IUPAC name of 1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine (CID 104736660) is 1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine.
What is the SMILES notation for 1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine?
The canonical SMILES for 1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine is CC1(C(N)Cc2cccnc2)CCCCO1.
What is the InChIKey of 1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine?
The InChIKey is SJKBOEQEKZCUFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-13(6-2-3-8-16-13)12(14)9-11-5-4-7-15-10-11/h4-5,7,10,12H,2-3,6,8-9,14H2,1H3.
What are the key properties of 1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine?
1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine has a molecular weight of 220.32 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyloxan-2-yl)-2-pyridin-3-ylethanamine is sourced from PubChem (CID 104736660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).