N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine

C15H26N2OS — CID 155794236

IUPACN,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCN(C)C1(COC(C)(C)C)CCC(c2nccs2)C1
InChIInChI=1S/C15H26N2OS/c1-14(2,3)18-11-15(17(4)5)7-6-12(10-15)13-16-8-9-19-13/h8-9,12H,6-7,10-11H2,1-5H3
InChIKeyQYMGSHKZQYKQGF-UHFFFAOYSA-N
MW282.45 g/mol
LogP3.53
Rot. Bonds4

About N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine

N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine (PubChem CID 155794236) has the molecular formula C15H26N2OS and a molecular weight of 282.45 g/mol. Its IUPAC name is N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine
PubChem CID155794236
Molecular FormulaC15H26N2OS
Molecular Weight282.45 g/mol
Exact Mass282.18
IUPAC NameN,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCN(C)C1(COC(C)(C)C)CCC(c2nccs2)C1
InChIInChI=1S/C15H26N2OS/c1-14(2,3)18-11-15(17(4)5)7-6-12(10-15)13-16-8-9-19-13/h8-9,12H,6-7,10-11H2,1-5H3
InChIKeyQYMGSHKZQYKQGF-UHFFFAOYSA-N
XLogP3.53
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.45
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine
CID 155794114
tert-butyl 2-(hydroxymethyl)-4-(1,3-thiazol-2-yl)pyrrolidine-1-carboxylate
CID 175438699
(4-methylpiperazin-1-yl)-[4-(1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 143718408
ethyl 2-methyl-4-(1,3-thiazol-2-yl)cyclohexane-1-carboxylate
CID 123485807
8-(1,3-thiazol-2-yl)spiro[4.5]decane-1,4-dione
CID 150389360
2-[1-(trideuteriomethyl)piperidin-4-yl]-1,3-thiazole
CID 170533293
tert-butyl 4-(5-bromo-1,3-thiazol-2-yl)piperidine-1-carboxylate;tert-butyl 4-(1,3-thiazol-2-yl)piperidine-1-carboxylate
CID 160889980
1-[4-(1,3-thiazol-2-yl)piperidin-1-yl]-3-[[1-(trifluoromethyl)cyclopropyl]methoxy]butan-1-one
CID 170759258
2-methyl-1-[3-(1,3-thiazol-2-yl)piperidin-1-yl]propan-2-ol
CID 110932618
1-[4-(1,3-thiazol-2-yl)piperidin-1-yl]propan-1-one
CID 71692446
[4-(1,3-thiazol-2-yl)cyclohexyl]methanamine;hydrochloride
CID 158523431
tert-butyl 1,1-dioxo-2-(1,3-thiazol-2-yl)-1,4-thiazinane-4-carboxylate
CID 155368811

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The IUPAC name of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine (CID 155794236) is N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine is CN(C)C1(COC(C)(C)C)CCC(c2nccs2)C1.
What is the InChIKey of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The InChIKey is QYMGSHKZQYKQGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2OS/c1-14(2,3)18-11-15(17(4)5)7-6-12(10-15)13-16-8-9-19-13/h8-9,12H,6-7,10-11H2,1-5H3.
What are the key properties of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine?
N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine has a molecular weight of 282.45 g/mol, XLogP of 3.53, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 155794236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).