methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate

C10H15N3O3S — CID 778121

IUPACmethyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate
SMILESCOC(=O)Nc1ncc(CN2CCOCC2)s1
InChIInChI=1S/C10H15N3O3S/c1-15-10(14)12-9-11-6-8(17-9)7-13-2-4-16-5-3-13/h6H,2-5,7H2,1H3,(H,11,12,14)
InChIKeyZVFJEWNRHDJBAR-UHFFFAOYSA-N
MW257.31 g/mol
LogP1.15
Rot. Bonds3

About methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate

methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate (PubChem CID 778121) has the molecular formula C10H15N3O3S and a molecular weight of 257.31 g/mol. Its IUPAC name is methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate.

Molecular Properties

Compound Namemethyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate
PubChem CID778121
Molecular FormulaC10H15N3O3S
Molecular Weight257.31 g/mol
Exact Mass257.08
IUPAC Namemethyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate
SMILESCOC(=O)Nc1ncc(CN2CCOCC2)s1
InChIInChI=1S/C10H15N3O3S/c1-15-10(14)12-9-11-6-8(17-9)7-13-2-4-16-5-3-13/h6H,2-5,7H2,1H3,(H,11,12,14)
InChIKeyZVFJEWNRHDJBAR-UHFFFAOYSA-N
XLogP1.15
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[2-[(5-Methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl] morpholine-4-carbodithioate
CID 900888
Methyl 5-(1-piperidinylmethyl)-1,3-thiazol-2-ylcarbamate
CID 822777
Ethyl 1-({2-[(methoxycarbonyl)amino]-1,3-thiazol-5-yl}methyl)piperidine-4-carboxylate
CID 718833
N-(5-methyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
CID 4464844
N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]acetamide
CID 686432
tert-butyl N-[5-(aminomethyl)-1,3-thiazol-2-yl]carbamate
CID 11601064
N,N-diethyl-5-[[(4-ethylmorpholin-2-yl)methylamino]methyl]-1,3-thiazol-2-amine
CID 53626923
Carbamic acid, [5-[(4-methyl-1-piperidinyl)methyl]-2-thiazolyl]-, methyl ester
CID 1258070
N-(5-methyl-1,3-thiazol-2-yl)-2-(morpholin-4-yl)acetamide
CID 17634923
1-(2-Methoxyethyl)-1-methyl-3-(5-methyl-1,3-thiazol-2-yl)urea
CID 47324781
5-(Morpholin-4-ylmethyl)-1,3-thiazol-2-amine;2,2,2-trifluoroacetic acid
CID 87112178
N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 155121219

Frequently Asked Questions

What is the IUPAC name of methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate?
The IUPAC name of methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate (CID 778121) is methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate.
What is the SMILES notation for methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate?
The canonical SMILES for methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate is COC(=O)Nc1ncc(CN2CCOCC2)s1.
What is the InChIKey of methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate?
The InChIKey is ZVFJEWNRHDJBAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3S/c1-15-10(14)12-9-11-6-8(17-9)7-13-2-4-16-5-3-13/h6H,2-5,7H2,1H3,(H,11,12,14).
What are the key properties of methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate?
methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate has a molecular weight of 257.31 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]carbamate is sourced from PubChem (CID 778121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).