[4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine

C12H19N3OS — CID 82437693

IUPAC[4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine
SMILESNCc1sc(CN2CCOCC2)nc1C1CC1
InChIInChI=1S/C12H19N3OS/c13-7-10-12(9-1-2-9)14-11(17-10)8-15-3-5-16-6-4-15/h9H,1-8,13H2
InChIKeyIDYDBMAXASTYGN-UHFFFAOYSA-N
MW253.37 g/mol
LogP1.31
Rot. Bonds4

About [4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine

[4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine (PubChem CID 82437693) has the molecular formula C12H19N3OS and a molecular weight of 253.37 g/mol. Its IUPAC name is [4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine
PubChem CID82437693
Molecular FormulaC12H19N3OS
Molecular Weight253.37 g/mol
Exact Mass253.12
IUPAC Name[4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine
SMILESNCc1sc(CN2CCOCC2)nc1C1CC1
InChIInChI=1S/C12H19N3OS/c13-7-10-12(9-1-2-9)14-11(17-10)8-15-3-5-16-6-4-15/h9H,1-8,13H2
InChIKeyIDYDBMAXASTYGN-UHFFFAOYSA-N
XLogP1.31
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanol
CID 82437678
(4-cyclopropyl-2-ethyl-1,3-thiazol-5-yl)methanamine
CID 82435899
[2-[2-(azepan-1-yl)ethyl]-4-cyclopropyl-1,3-thiazol-5-yl]methanamine
CID 82437914
[4-cyclopropyl-2-(4-ethylmorpholin-2-yl)-1,3-thiazol-5-yl]methanamine
CID 114361926
[4-cyclopropyl-2-(ethylsulfonylmethyl)-1,3-thiazol-5-yl]methanamine
CID 82436840
N-[[2-(azepan-1-ylmethyl)-4-cyclopropyl-1,3-thiazol-5-yl]methyl]ethanamine
CID 82437923
2-[4-cyclopropyl-2-[(4-methylpiperazin-1-yl)methyl]-1,3-thiazol-5-yl]acetic acid
CID 82437711
[4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazol-5-yl]methanamine
CID 82427518
[2-(morpholin-4-ylmethyl)-4-propan-2-yl-1,3-thiazol-5-yl]methanethiol
CID 82435326
[2-(butan-2-ylsulfanylmethyl)-4-cyclopropyl-1,3-thiazol-5-yl]methanamine
CID 114361967
4-cyclopropyl-2-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carbohydrazide
CID 82437904
[4-cyclopropyl-2-(4-ethoxyoxan-4-yl)-1,3-thiazol-5-yl]methanamine
CID 114361912

Frequently Asked Questions

What is the IUPAC name of [4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine?
The IUPAC name of [4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine (CID 82437693) is [4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine.
What is the SMILES notation for [4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine?
The canonical SMILES for [4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine is NCc1sc(CN2CCOCC2)nc1C1CC1.
What is the InChIKey of [4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine?
The InChIKey is IDYDBMAXASTYGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3OS/c13-7-10-12(9-1-2-9)14-11(17-10)8-15-3-5-16-6-4-15/h9H,1-8,13H2.
What are the key properties of [4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine?
[4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine has a molecular weight of 253.37 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-cyclopropyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-yl]methanamine is sourced from PubChem (CID 82437693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).