(1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine

C14H17N3O — CID 103938021

IUPAC(1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine
SMILESCC[C@H](N)c1ccc(Oc2cccnc2C)cn1
InChIInChI=1S/C14H17N3O/c1-3-12(15)13-7-6-11(9-17-13)18-14-5-4-8-16-10(14)2/h4-9,12H,3,15H2,1-2H3/t12-/m0/s1
InChIKeyNYHXQZDRUOYTHK-LBPRGKRZSA-N
MW243.31 g/mol
LogP2.99
Rot. Bonds4

About (1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine

(1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine (PubChem CID 103938021) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is (1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine.

Molecular Properties

Compound Name(1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine
PubChem CID103938021
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name(1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine
SMILESCC[C@H](N)c1ccc(Oc2cccnc2C)cn1
InChIInChI=1S/C14H17N3O/c1-3-12(15)13-7-6-11(9-17-13)18-14-5-4-8-16-10(14)2/h4-9,12H,3,15H2,1-2H3/t12-/m0/s1
InChIKeyNYHXQZDRUOYTHK-LBPRGKRZSA-N
XLogP2.99
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine with MolForge

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Related Compounds

(1R)-1-(5-quinolin-5-yloxy-2-pyridinyl)propan-1-amine
CID 103044924
(1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol
CID 83125304
1-[5-(2-propan-2-ylphenoxy)-2-pyridinyl]propan-1-amine
CID 115939981
(1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine
CID 103937652
2-[[6-[(1R)-1-aminopropyl]-3-pyridinyl]oxy]benzamide
CID 103937678
(1R)-1-[5-(2-methyl-5-propan-2-ylphenoxy)-2-pyridinyl]propan-1-amine
CID 103937883
(1S)-1-[5-(5-methyl-2-propan-2-ylphenoxy)-2-pyridinyl]propan-1-amine
CID 103937752
(1R)-1-[5-(5-methyl-2-propan-2-ylphenoxy)-2-pyridinyl]propan-1-amine
CID 103937751
(1S)-1-[5-(4-bromophenoxy)-2-pyridinyl]propan-1-amine
CID 103937759
(1S)-1-[5-(4-iodophenoxy)-2-pyridinyl]propan-1-amine
CID 103937836
1-[5-(2-bromo-4-methoxyphenoxy)-2-pyridinyl]propan-1-amine
CID 104707911
1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine
CID 112584748

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine?
The IUPAC name of (1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine (CID 103938021) is (1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine.
What is the SMILES notation for (1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine?
The canonical SMILES for (1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine is CC[C@H](N)c1ccc(Oc2cccnc2C)cn1.
What is the InChIKey of (1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine?
The InChIKey is NYHXQZDRUOYTHK-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H17N3O/c1-3-12(15)13-7-6-11(9-17-13)18-14-5-4-8-16-10(14)2/h4-9,12H,3,15H2,1-2H3/t12-/m0/s1.
What are the key properties of (1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine?
(1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine has a molecular weight of 243.31 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 103938021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).