N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine

C11H18N2OS — CID 115625486

IUPACN-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine
SMILESCOCC(C)NCc1csc(C2CC2)n1
InChIInChI=1S/C11H18N2OS/c1-8(6-14-2)12-5-10-7-15-11(13-10)9-3-4-9/h7-9,12H,3-6H2,1-2H3
InChIKeyQDAFHXUNIQVICN-UHFFFAOYSA-N
MW226.34 g/mol
LogP2.14
Rot. Bonds6

About N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine

N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine (PubChem CID 115625486) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine.

Molecular Properties

Compound NameN-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine
PubChem CID115625486
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC NameN-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine
SMILESCOCC(C)NCc1csc(C2CC2)n1
InChIInChI=1S/C11H18N2OS/c1-8(6-14-2)12-5-10-7-15-11(13-10)9-3-4-9/h7-9,12H,3-6H2,1-2H3
InChIKeyQDAFHXUNIQVICN-UHFFFAOYSA-N
XLogP2.14
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine 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

2-[(2-cyclopropyl-1,3-thiazol-4-yl)methylamino]propan-1-ol
CID 115656408
N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-3-methylbutan-2-amine
CID 115625561
N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]ethanamine
CID 61281051
N-ethyl-N-[4-[(1-methoxypropan-2-ylamino)methyl]-1,3-thiazol-2-yl]acetamide
CID 43226283
(2S)-1-methoxy-N-(thiadiazol-4-ylmethyl)propan-2-amine
CID 93257833
1-(2-cyclohexyl-1,3-thiazol-4-yl)-N-methylmethanamine
CID 61280857
N-[(2-cyclopentyl-1,3-thiazol-4-yl)methyl]cyclopropanamine
CID 61280289
N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-2-ethylbutanamide
CID 75358505
2-cyclobutyl-4-(2-methylpropyl)-1,3-thiazole
CID 130891959
N-[[2-(2,2-dimethylcyclopropyl)-1,3-thiazol-4-yl]methyl]propan-2-amine
CID 107925558
1-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propan-2-amine
CID 62845537
N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-(thiolan-2-yl)methanamine
CID 115690921

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine?
The IUPAC name of N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine (CID 115625486) is N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine.
What is the SMILES notation for N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine?
The canonical SMILES for N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine is COCC(C)NCc1csc(C2CC2)n1.
What is the InChIKey of N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine?
The InChIKey is QDAFHXUNIQVICN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-8(6-14-2)12-5-10-7-15-11(13-10)9-3-4-9/h7-9,12H,3-6H2,1-2H3.
What are the key properties of N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine?
N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine has a molecular weight of 226.34 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]-1-methoxypropan-2-amine is sourced from PubChem (CID 115625486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).