[4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine

C16H21N3S — CID 62765022

IUPAC[4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine
SMILESCCc1nc(N2CCCc3cc(C)ccc32)sc1CN
InChIInChI=1S/C16H21N3S/c1-3-13-15(10-17)20-16(18-13)19-8-4-5-12-9-11(2)6-7-14(12)19/h6-7,9H,3-5,8,10,17H2,1-2H3
InChIKeyHYVLQONIKWWYSA-UHFFFAOYSA-N
MW287.43 g/mol
LogP3.56
Rot. Bonds3

About [4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine

[4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine (PubChem CID 62765022) has the molecular formula C16H21N3S and a molecular weight of 287.43 g/mol. Its IUPAC name is [4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine
PubChem CID62765022
Molecular FormulaC16H21N3S
Molecular Weight287.43 g/mol
Exact Mass287.15
IUPAC Name[4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine
SMILESCCc1nc(N2CCCc3cc(C)ccc32)sc1CN
InChIInChI=1S/C16H21N3S/c1-3-13-15(10-17)20-16(18-13)19-8-4-5-12-9-11(2)6-7-14(12)19/h6-7,9H,3-5,8,10,17H2,1-2H3
InChIKeyHYVLQONIKWWYSA-UHFFFAOYSA-N
XLogP3.56
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.43
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine with MolForge

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Related Compounds

{5-[(Cyclopropylmethyl-propyl-amino)-methyl]-4-trifluoromethyl-thiazol-2-yl}-(2,4,6-trimethyl-phenyl)-amine
CID 44352448
4-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide
CID 71657336
N-(2,4-dimethylphenyl)-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-amine
CID 777511
N-(2,6-diethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine;hydrobromide
CID 17752875
(4,5-Dimethyl-Thiazol-2-Yl)-(2,4,6-Trimethyl-Phenyl)-Amine
CID 71561950
6-(2-Amino-1,3-thiazol-4-yl)-3-methyl-1,2,3,4-tetrahydroquinazolin-2-one
CID 13827169
{5-[(Cyclopropylmethyl-propyl-amino)-methyl]-4-trifluoromethyl-thiazol-2-yl}-(2,6-diethyl-phenyl)-amine
CID 44352349
N-[4-[2-(dimethylamino)ethyl]phenyl]-4-methyl-1,3-thiazol-2-amine
CID 137645162
N-[4-(ethylaminomethyl)phenyl]-4-methyl-1,3-thiazol-2-amine
CID 137661691
N-(2,6-dimethylphenyl)-3,4-dimethyl-1,3-thiazol-3-ium-2-amine iodide
CID 2826700
4-tert-butyl-N-(2,4-dimethylphenyl)-1,3-thiazol-2-amine
CID 2798716
N-(2-methylpropyl)-4-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-1,3-thiazol-2-amine
CID 9343332

Frequently Asked Questions

What is the IUPAC name of [4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine?
The IUPAC name of [4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine (CID 62765022) is [4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine.
What is the SMILES notation for [4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine?
The canonical SMILES for [4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine is CCc1nc(N2CCCc3cc(C)ccc32)sc1CN.
What is the InChIKey of [4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine?
The InChIKey is HYVLQONIKWWYSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3S/c1-3-13-15(10-17)20-16(18-13)19-8-4-5-12-9-11(2)6-7-14(12)19/h6-7,9H,3-5,8,10,17H2,1-2H3.
What are the key properties of [4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine?
[4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine has a molecular weight of 287.43 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1,3-thiazol-5-yl]methanamine is sourced from PubChem (CID 62765022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).