[2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine

C16H21N3S — CID 62766572

IUPAC[2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine
SMILESCCCc1nc(N2CCCc3ccccc32)sc1CN
InChIInChI=1S/C16H21N3S/c1-2-6-13-15(11-17)20-16(18-13)19-10-5-8-12-7-3-4-9-14(12)19/h3-4,7,9H,2,5-6,8,10-11,17H2,1H3
InChIKeyMOXAXRLDHPALDQ-UHFFFAOYSA-N
MW287.43 g/mol
LogP3.64
Rot. Bonds4

About [2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine

[2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine (PubChem CID 62766572) has the molecular formula C16H21N3S and a molecular weight of 287.43 g/mol. Its IUPAC name is [2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine
PubChem CID62766572
Molecular FormulaC16H21N3S
Molecular Weight287.43 g/mol
Exact Mass287.15
IUPAC Name[2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine
SMILESCCCc1nc(N2CCCc3ccccc32)sc1CN
InChIInChI=1S/C16H21N3S/c1-2-6-13-15(11-17)20-16(18-13)19-10-5-8-12-7-3-4-9-14(12)19/h3-4,7,9H,2,5-6,8,10-11,17H2,1H3
InChIKeyMOXAXRLDHPALDQ-UHFFFAOYSA-N
XLogP3.64
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.43
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine 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

1-[2-(3,4-dihydro-2H-quinolin-1-yl)-4-ethyl-1,3-thiazol-5-yl]-N-methylmethanamine
CID 62763943
[4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 62765022
3-[2-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-1,3-thiazol-5-yl]propanoic acid
CID 82161957
[4-cyclopropyl-2-(2,3-dihydroindol-1-yl)-1,3-thiazol-5-yl]methanamine
CID 63916745
2-(3,4-dihydro-2H-quinolin-1-yl)-4-(methoxymethyl)-1,3-thiazole-5-carbaldehyde
CID 107508921
[2-(3,4-dihydro-2H-1,5-benzoxazepin-5-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]methanamine
CID 107510701
ethyl 2-(3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazole-4-carboxylate
CID 80567840
[2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine
CID 65322070
ethyl 2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)-1,3-thiazole-4-carboxylate
CID 80569322
1-(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-3,4-dihydro-2H-quinoline
CID 80980277
2-(3,4-dihydro-2H-quinolin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazol-4-ol
CID 64977604
N-[[6-(3,4-dihydro-2H-quinolin-1-yl)pyrazin-2-yl]methyl]ethanamine
CID 66456379

Frequently Asked Questions

What is the IUPAC name of [2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine?
The IUPAC name of [2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine (CID 62766572) is [2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine.
What is the SMILES notation for [2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine?
The canonical SMILES for [2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine is CCCc1nc(N2CCCc3ccccc32)sc1CN.
What is the InChIKey of [2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine?
The InChIKey is MOXAXRLDHPALDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3S/c1-2-6-13-15(11-17)20-16(18-13)19-10-5-8-12-7-3-4-9-14(12)19/h3-4,7,9H,2,5-6,8,10-11,17H2,1H3.
What are the key properties of [2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine?
[2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine has a molecular weight of 287.43 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,4-dihydro-2H-quinolin-1-yl)-4-propyl-1,3-thiazol-5-yl]methanamine is sourced from PubChem (CID 62766572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).