1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine

C11H13N3S — CID 112642945

IUPAC1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine
SMILESNC(Cc1ccncc1)Cc1cncs1
InChIInChI=1S/C11H13N3S/c12-10(6-11-7-14-8-15-11)5-9-1-3-13-4-2-9/h1-4,7-8,10H,5-6,12H2
InChIKeyOGNOYUSNXADERH-UHFFFAOYSA-N
MW219.31 g/mol
LogP1.65
Rot. Bonds4

About 1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine

1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine (PubChem CID 112642945) has the molecular formula C11H13N3S and a molecular weight of 219.31 g/mol. Its IUPAC name is 1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine.

Molecular Properties

Compound Name1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine
PubChem CID112642945
Molecular FormulaC11H13N3S
Molecular Weight219.31 g/mol
Exact Mass219.08
IUPAC Name1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine
SMILESNC(Cc1ccncc1)Cc1cncs1
InChIInChI=1S/C11H13N3S/c12-10(6-11-7-14-8-15-11)5-9-1-3-13-4-2-9/h1-4,7-8,10H,5-6,12H2
InChIKeyOGNOYUSNXADERH-UHFFFAOYSA-N
XLogP1.65
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanamine
CID 112642722
2-amino-3-(1,3-thiazol-5-yl)propan-1-ol;hydrochloride
CID 22747843
1-(3-methylphenyl)-3-(1,3-thiazol-5-yl)propan-2-amine
CID 112642897
1-(4-iodophenyl)-3-pyridin-4-ylpropan-2-amine
CID 65476489
1-pyridin-4-yl-2-(1,3-thiazol-5-yl)ethanol
CID 112641839
1-(1,3-thiazol-5-yl)propan-2-amine
CID 60748054
1-pyridin-4-yl-N-(1,3-thiazol-5-ylmethyl)methanamine
CID 62758662
1-(1,3-thiazol-5-yl)heptan-2-amine
CID 105030705
1-cycloheptyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 105030739
[1-(4-bromophenyl)-3-(1,3-thiazol-5-yl)propan-2-yl]hydrazine
CID 105195489
4-amino-1-(1,3-thiazol-5-yl)butan-2-ol
CID 82411793
4-(2-methoxyethoxy)-1-(1,3-thiazol-5-yl)butan-2-amine
CID 102927931

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine?
The IUPAC name of 1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine (CID 112642945) is 1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine.
What is the SMILES notation for 1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine?
The canonical SMILES for 1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine is NC(Cc1ccncc1)Cc1cncs1.
What is the InChIKey of 1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine?
The InChIKey is OGNOYUSNXADERH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3S/c12-10(6-11-7-14-8-15-11)5-9-1-3-13-4-2-9/h1-4,7-8,10H,5-6,12H2.
What are the key properties of 1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine?
1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine has a molecular weight of 219.31 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-4-yl-3-(1,3-thiazol-5-yl)propan-2-amine is sourced from PubChem (CID 112642945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).