N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine

C14H19N3OS — CID 114937738

IUPACN-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine
SMILESCOc1ccc(C(NC(C)C)c2nc(C)cs2)cn1
InChIInChI=1S/C14H19N3OS/c1-9(2)16-13(14-17-10(3)8-19-14)11-5-6-12(18-4)15-7-11/h5-9,13,16H,1-4H3
InChIKeyGCZSRIDTLKKRRN-UHFFFAOYSA-N
MW277.39 g/mol
LogP2.94
Rot. Bonds5

About N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine

N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine (PubChem CID 114937738) has the molecular formula C14H19N3OS and a molecular weight of 277.39 g/mol. Its IUPAC name is N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine
PubChem CID114937738
Molecular FormulaC14H19N3OS
Molecular Weight277.39 g/mol
Exact Mass277.12
IUPAC NameN-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine
SMILESCOc1ccc(C(NC(C)C)c2nc(C)cs2)cn1
InChIInChI=1S/C14H19N3OS/c1-9(2)16-13(14-17-10(3)8-19-14)11-5-6-12(18-4)15-7-11/h5-9,13,16H,1-4H3
InChIKeyGCZSRIDTLKKRRN-UHFFFAOYSA-N
XLogP2.94
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(6-methoxy-3-pyridinyl)-N-methyl-1-(4-methyl-1,3-thiazol-2-yl)methanamine
CID 114937719
N-[(4-fluorophenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 61335982
N-[(3-bromo-4-methylphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 105402371
N-[(3-fluorophenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 61333244
N-[(1-ethylpyrazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 103570199
N-[(2,5-difluorophenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 61334813
N-[(4-methyl-1,3-thiazol-2-yl)-[2-(trifluoromethyl)phenyl]methyl]propan-2-amine
CID 61334029
N-[(2-bromo-5-chlorophenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 66156268
N-[(4,5-dimethyl-1,3-thiazol-2-yl)-(6-methoxy-3-pyridinyl)methyl]cyclopropanamine
CID 114937745
6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)pyridine-3-sulfonamide
CID 99837871
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-(6-methoxy-3-pyridinyl)-N-methylmethanamine
CID 114937723
2-[methoxy-(4-methoxyphenyl)methyl]-4-methyl-1,3-thiazole
CID 119084444

Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine?
The IUPAC name of N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine (CID 114937738) is N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine.
What is the SMILES notation for N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine?
The canonical SMILES for N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine is COc1ccc(C(NC(C)C)c2nc(C)cs2)cn1.
What is the InChIKey of N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine?
The InChIKey is GCZSRIDTLKKRRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3OS/c1-9(2)16-13(14-17-10(3)8-19-14)11-5-6-12(18-4)15-7-11/h5-9,13,16H,1-4H3.
What are the key properties of N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine?
N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine has a molecular weight of 277.39 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxy-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methyl]propan-2-amine is sourced from PubChem (CID 114937738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).