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

C14H19N3S — CID 112642797

IUPACN-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine
SMILESCCCNC(Cc1ccccn1)Cc1cncs1
InChIInChI=1S/C14H19N3S/c1-2-6-16-13(9-14-10-15-11-18-14)8-12-5-3-4-7-17-12/h3-5,7,10-11,13,16H,2,6,8-9H2,1H3
InChIKeyWDCINQJLCORNGK-UHFFFAOYSA-N
MW261.39 g/mol
LogP2.69
Rot. Bonds7

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

N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine (PubChem CID 112642797) has the molecular formula C14H19N3S and a molecular weight of 261.39 g/mol. Its IUPAC name is N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine.

Molecular Properties

Compound NameN-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine
PubChem CID112642797
Molecular FormulaC14H19N3S
Molecular Weight261.39 g/mol
Exact Mass261.13
IUPAC NameN-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine
SMILESCCCNC(Cc1ccccn1)Cc1cncs1
InChIInChI=1S/C14H19N3S/c1-2-6-16-13(9-14-10-15-11-18-14)8-12-5-3-4-7-17-12/h3-5,7,10-11,13,16H,2,6,8-9H2,1H3
InChIKeyWDCINQJLCORNGK-UHFFFAOYSA-N
XLogP2.69
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-pyrimidin-2-yl-2-(1,3-thiazol-5-yl)ethyl]propan-1-amine
CID 112642835
1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine
CID 60818337
4-(2-methylphenyl)-N-propyl-1-(1,3-thiazol-5-yl)butan-2-amine
CID 105178082
1-(3-fluorophenyl)-N-propyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 112642847
1-(4-methoxyphenyl)-N-propyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 115979174
4-methylsulfanyl-N-propyl-1-pyridin-2-ylbutan-2-amine
CID 105157999
4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine
CID 62600384
1-propan-2-ylsulfanyl-N-propyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 112643118
1-(3-chlorophenoxy)-N-propyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 105177967
5-methoxy-N-propyl-1-(1,3-thiazol-5-yl)pentan-2-amine
CID 112643106
1-butan-2-ylsulfanyl-N-propyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 112643130
1-(oxan-4-yl)-N-propyl-3-pyridin-2-ylpropan-2-amine
CID 62600579

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine?
The IUPAC name of N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine (CID 112642797) is N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine.
What is the SMILES notation for N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine?
The canonical SMILES for N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine is CCCNC(Cc1ccccn1)Cc1cncs1.
What is the InChIKey of N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine?
The InChIKey is WDCINQJLCORNGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S/c1-2-6-16-13(9-14-10-15-11-18-14)8-12-5-3-4-7-17-12/h3-5,7,10-11,13,16H,2,6,8-9H2,1H3.
What are the key properties of N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine?
N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine has a molecular weight of 261.39 g/mol, XLogP of 2.69, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine is sourced from PubChem (CID 112642797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).