N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine

C7H12N2OS — CID 43079498

IUPACN-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine
SMILESCOCC(C)Nc1nccs1
InChIInChI=1S/C7H12N2OS/c1-6(5-10-2)9-7-8-3-4-11-7/h3-4,6H,5H2,1-2H3,(H,8,9)
InChIKeyMSKINGCLWONOTB-UHFFFAOYSA-N
MW172.25 g/mol
LogP1.59
Rot. Bonds4

About N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine

N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine (PubChem CID 43079498) has the molecular formula C7H12N2OS and a molecular weight of 172.25 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine
PubChem CID43079498
Molecular FormulaC7H12N2OS
Molecular Weight172.25 g/mol
Exact Mass172.07
IUPAC NameN-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine
SMILESCOCC(C)Nc1nccs1
InChIInChI=1S/C7H12N2OS/c1-6(5-10-2)9-7-8-3-4-11-7/h3-4,6H,5H2,1-2H3,(H,8,9)
InChIKeyMSKINGCLWONOTB-UHFFFAOYSA-N
XLogP1.59
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.25
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-methylphenoxy)propan-2-yl]-1,3-thiazol-2-amine
CID 61166762
N-propan-2-yl-1,3-thiazol-2-amine
CID 2160964
N-[1-(4-methoxyphenyl)propan-2-yl]-1,3-thiazol-2-amine
CID 79046617
N-[4-(4-methoxyphenyl)butan-2-yl]-1,3-thiazol-2-amine
CID 78978381
1-(1,3-thiazol-2-ylamino)propane-1-thiol
CID 123498240
N-(3-chloro-4-methoxybutyl)-1,3-thiazol-2-amine
CID 106243006
1-methoxy-N-[3-(1,3-thiazol-2-ylsulfanyl)propyl]propan-2-amine
CID 115721340
N-[1-(1,3-thiazol-2-yl)ethyl]-1,3-thiazol-2-amine
CID 63612751
N-(3,3-dimethylbutan-2-yl)-1,3-thiazol-2-amine
CID 104828727
2-(1-methoxypropan-2-yl)-1,3-thiazole
CID 162112968
N-but-3-yn-2-yl-1,3-thiazol-2-amine
CID 114417967
5-ethyl-N-(1-methoxypropan-2-yl)-1,3,4-thiadiazol-2-amine
CID 107647778

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine (CID 43079498) is N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine is COCC(C)Nc1nccs1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine?
The InChIKey is MSKINGCLWONOTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2OS/c1-6(5-10-2)9-7-8-3-4-11-7/h3-4,6H,5H2,1-2H3,(H,8,9).
What are the key properties of N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine?
N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine has a molecular weight of 172.25 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 43079498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).