[1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol

C10H17N3OS — CID 115763226

IUPAC[1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol
SMILESCN(C)c1ncc(CNC2(CO)CC2)s1
InChIInChI=1S/C10H17N3OS/c1-13(2)9-11-5-8(15-9)6-12-10(7-14)3-4-10/h5,12,14H,3-4,6-7H2,1-2H3
InChIKeyZWZJOSCWYNQAQQ-UHFFFAOYSA-N
MW227.33 g/mol
LogP0.82
Rot. Bonds5

About [1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol

[1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol (PubChem CID 115763226) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is [1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol
PubChem CID115763226
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC Name[1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol
SMILESCN(C)c1ncc(CNC2(CO)CC2)s1
InChIInChI=1S/C10H17N3OS/c1-13(2)9-11-5-8(15-9)6-12-10(7-14)3-4-10/h5,12,14H,3-4,6-7H2,1-2H3
InChIKeyZWZJOSCWYNQAQQ-UHFFFAOYSA-N
XLogP0.82
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[1-[(2-ethyl-1,3-thiazol-5-yl)methylamino]cyclopropyl]methanol
CID 115763147
[1-[(2-methyl-1,3-thiazol-5-yl)methylamino]cyclopentyl]methanol
CID 62522547
[1-[(2-amino-1,3-thiazol-5-yl)methylamino]cyclobutyl]methanol
CID 120902030
[1-[(2-cyclobutyl-1,3-thiazol-5-yl)methylamino]cyclopropyl]methanol
CID 115763054
5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine
CID 61037566
(2S)-2-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]-3-methylbutan-1-ol
CID 103735392
3-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]-2-methylpropan-1-ol
CID 115592480
N,N-dimethyl-5-[[(1-methylpyrazol-4-yl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 115607960
5-[(3-ethoxypropylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine;hydrochloride
CID 115587033
[1-(1,3-thiazol-5-ylmethylamino)cyclohexyl]methanol
CID 62759471
[1-[(5-chloro-1,3-thiazol-2-yl)methylamino]cyclopropyl]methanol
CID 104879507
5-[(2-cyclopropylethylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine
CID 115656457

Frequently Asked Questions

What is the IUPAC name of [1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol?
The IUPAC name of [1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol (CID 115763226) is [1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol.
What is the SMILES notation for [1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol?
The canonical SMILES for [1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol is CN(C)c1ncc(CNC2(CO)CC2)s1.
What is the InChIKey of [1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol?
The InChIKey is ZWZJOSCWYNQAQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS/c1-13(2)9-11-5-8(15-9)6-12-10(7-14)3-4-10/h5,12,14H,3-4,6-7H2,1-2H3.
What are the key properties of [1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol?
[1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol has a molecular weight of 227.33 g/mol, XLogP of 0.82, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methylamino]cyclopropyl]methanol is sourced from PubChem (CID 115763226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).