5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine

C17H24N4OS — CID 139500116

IUPAC5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine
SMILESCNc1ncc(CN2CCCC(Cc3cccc(OC)n3)C2)s1
InChIInChI=1S/C17H24N4OS/c1-18-17-19-10-15(23-17)12-21-8-4-5-13(11-21)9-14-6-3-7-16(20-14)22-2/h3,6-7,10,13H,4-5,8-9,11-12H2,1-2H3,(H,18,19)
InChIKeyKMEIQWRKFHVPBY-UHFFFAOYSA-N
MW332.47 g/mol
LogP3.04
Rot. Bonds6

About 5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine

5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine (PubChem CID 139500116) has the molecular formula C17H24N4OS and a molecular weight of 332.47 g/mol. Its IUPAC name is 5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine
PubChem CID139500116
Molecular FormulaC17H24N4OS
Molecular Weight332.47 g/mol
Exact Mass332.17
IUPAC Name5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine
SMILESCNc1ncc(CN2CCCC(Cc3cccc(OC)n3)C2)s1
InChIInChI=1S/C17H24N4OS/c1-18-17-19-10-15(23-17)12-21-8-4-5-13(11-21)9-14-6-3-7-16(20-14)22-2/h3,6-7,10,13H,4-5,8-9,11-12H2,1-2H3,(H,18,19)
InChIKeyKMEIQWRKFHVPBY-UHFFFAOYSA-N
XLogP3.04
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.47
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-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-[5-[[3-[(6-methoxypyrazin-2-yl)methyl]pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 135135387
2-methoxy-N-[[1-[(6-methoxy-2-pyridinyl)methyl]piperidin-3-yl]methyl]ethanamine
CID 63987091
N-[5-[[(3R)-3-[(2,6-dimethylpyrimidin-4-yl)methyl]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 135135074
2-[(3-chloropiperidin-1-yl)methyl]-6-methoxypyridine
CID 63984943
2-[5-[[3-[(2-methoxy-4-pyridinyl)methyl]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 168858933
N-[5-[[(3S)-3-[(5-fluoro-3-pyridinyl)methyl]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 139491347
2-methyl-6-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyridine
CID 127246408
2-methoxy-6-(piperidin-1-ylmethyl)pyridine
CID 70652671
N-[5-[[(3R)-3-[[5-(trifluoromethyl)pyrimidin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 139500930
5-[(3-methoxypiperidin-1-yl)methyl]-N-propyl-1,3-thiazol-2-amine
CID 102966743
5-[[(3S)-3-(1H-benzimidazol-2-ylmethyl)piperidin-1-yl]methyl]-2-methyl-1,3-thiazole
CID 92628816
N-[5-[[3-[[2-methoxy-6-(trifluoromethyl)-4-pyridinyl]methyl]pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 135135233

Frequently Asked Questions

What is the IUPAC name of 5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine?
The IUPAC name of 5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine (CID 139500116) is 5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine is CNc1ncc(CN2CCCC(Cc3cccc(OC)n3)C2)s1.
What is the InChIKey of 5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine?
The InChIKey is KMEIQWRKFHVPBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4OS/c1-18-17-19-10-15(23-17)12-21-8-4-5-13(11-21)9-14-6-3-7-16(20-14)22-2/h3,6-7,10,13H,4-5,8-9,11-12H2,1-2H3,(H,18,19).
What are the key properties of 5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine?
5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine has a molecular weight of 332.47 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[3-[(6-methoxy-2-pyridinyl)methyl]piperidin-1-yl]methyl]-N-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 139500116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).