[4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine

C13H19N3OS — CID 66370249

IUPAC[4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine
SMILESNCc1sc(N2CC3CCC(C2)O3)nc1C1CC1
InChIInChI=1S/C13H19N3OS/c14-5-11-12(8-1-2-8)15-13(18-11)16-6-9-3-4-10(7-16)17-9/h8-10H,1-7,14H2
InChIKeyDSDWOWNMXSMQCA-UHFFFAOYSA-N
MW265.38 g/mol
LogP1.85
Rot. Bonds3

About [4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine

[4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine (PubChem CID 66370249) has the molecular formula C13H19N3OS and a molecular weight of 265.38 g/mol. Its IUPAC name is [4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine
PubChem CID66370249
Molecular FormulaC13H19N3OS
Molecular Weight265.38 g/mol
Exact Mass265.12
IUPAC Name[4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine
SMILESNCc1sc(N2CC3CCC(C2)O3)nc1C1CC1
InChIInChI=1S/C13H19N3OS/c14-5-11-12(8-1-2-8)15-13(18-11)16-6-9-3-4-10(7-16)17-9/h8-10H,1-7,14H2
InChIKeyDSDWOWNMXSMQCA-UHFFFAOYSA-N
XLogP1.85
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine 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

[4-cyclopropyl-2-(3,4-dimethoxypyrrolidin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 103540374
(4-cyclopropyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methanamine
CID 63918102
[4-cyclopropyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 63916249
[2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-4-cyclopropyl-1,3-thiazol-5-yl]methanamine
CID 63915854
[4-cyclopropyl-2-(4,4-diethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 63917608
[4-cyclopropyl-2-(3-phenylpyrrolidin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 63915599
[4-cyclopropyl-2-[4-(2-methylpropyl)piperazin-1-yl]-1,3-thiazol-5-yl]methanamine
CID 63916433
[4-cyclopropyl-2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-1,3-thiazol-5-yl]methanamine
CID 64580056
[4-cyclopropyl-2-(2-methylpiperidin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 63916747
[4-cyclopropyl-2-(2-ethylpyrrolidin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 63916547
[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-4-phenyl-1,3-thiazol-5-yl]methanol
CID 66371626
N-[[4-cyclopropyl-2-(3,4-dimethylpyrrolidin-1-yl)-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 79178304

Frequently Asked Questions

What is the IUPAC name of [4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine?
The IUPAC name of [4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine (CID 66370249) is [4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine.
What is the SMILES notation for [4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine?
The canonical SMILES for [4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine is NCc1sc(N2CC3CCC(C2)O3)nc1C1CC1.
What is the InChIKey of [4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine?
The InChIKey is DSDWOWNMXSMQCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3OS/c14-5-11-12(8-1-2-8)15-13(18-11)16-6-9-3-4-10(7-16)17-9/h8-10H,1-7,14H2.
What are the key properties of [4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine?
[4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine has a molecular weight of 265.38 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-cyclopropyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine is sourced from PubChem (CID 66370249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).