N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine

C14H25N3OS — CID 62961753

IUPACN-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine
SMILESCCc1csc(N2CCCCC2CNCCOC)n1
InChIInChI=1S/C14H25N3OS/c1-3-12-11-19-14(16-12)17-8-5-4-6-13(17)10-15-7-9-18-2/h11,13,15H,3-10H2,1-2H3
InChIKeyCJNADRZSRQNBFY-UHFFFAOYSA-N
MW283.44 g/mol
LogP2.30
Rot. Bonds7

About N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine

N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine (PubChem CID 62961753) has the molecular formula C14H25N3OS and a molecular weight of 283.44 g/mol. Its IUPAC name is N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine.

Molecular Properties

Compound NameN-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine
PubChem CID62961753
Molecular FormulaC14H25N3OS
Molecular Weight283.44 g/mol
Exact Mass283.17
IUPAC NameN-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine
SMILESCCc1csc(N2CCCCC2CNCCOC)n1
InChIInChI=1S/C14H25N3OS/c1-3-12-11-19-14(16-12)17-8-5-4-6-13(17)10-15-7-9-18-2/h11,13,15H,3-10H2,1-2H3
InChIKeyCJNADRZSRQNBFY-UHFFFAOYSA-N
XLogP2.30
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]propan-2-amine
CID 62961398
N-[[1-(3-ethyl-1,2,4-thiadiazol-5-yl)piperidin-2-yl]methyl]-2-methoxyethanamine
CID 65280822
N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]cyclopropanamine
CID 62961582
N-[[1-(4-ethyl-1,3-thiazol-2-yl)pyrrolidin-2-yl]methyl]propan-2-amine
CID 62960856
N-[[1-(3-ethyl-1,2,4-thiadiazol-5-yl)pyrrolidin-2-yl]methyl]-2-methoxyethanamine
CID 65279971
2-methoxy-N-[[1-(4-methoxypyrimidin-2-yl)piperidin-2-yl]methyl]ethanamine
CID 62587593
N-[[1-(1,3-benzoxazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine
CID 62585619
3-[1-(4-ethyl-1,3-thiazol-2-yl)pyrrolidin-2-yl]propan-1-amine
CID 63760448
1-[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]ethanone
CID 63844473
4-(chloromethyl)-2-(2-ethylpyrrolidin-1-yl)-1,3-thiazole
CID 60974332
N-[[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)piperidin-2-yl]methyl]-2-methoxyethanamine
CID 115332080
ethyl 2-[2-(2-ethylpiperidin-1-yl)-1,3-thiazol-4-yl]acetate
CID 80574752

Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine?
The IUPAC name of N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine (CID 62961753) is N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine.
What is the SMILES notation for N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine?
The canonical SMILES for N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine is CCc1csc(N2CCCCC2CNCCOC)n1.
What is the InChIKey of N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine?
The InChIKey is CJNADRZSRQNBFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3OS/c1-3-12-11-19-14(16-12)17-8-5-4-6-13(17)10-15-7-9-18-2/h11,13,15H,3-10H2,1-2H3.
What are the key properties of N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine?
N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine has a molecular weight of 283.44 g/mol, XLogP of 2.30, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(4-ethyl-1,3-thiazol-2-yl)piperidin-2-yl]methyl]-2-methoxyethanamine is sourced from PubChem (CID 62961753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).