N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine

C8H12N2OS — CID 164656950

IUPACN-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine
SMILESCC1OCCC1Nc1cnsc1
InChIInChI=1S/C8H12N2OS/c1-6-8(2-3-11-6)10-7-4-9-12-5-7/h4-6,8,10H,2-3H2,1H3
InChIKeyZKMKFPPWWCKRPB-UHFFFAOYSA-N
MW184.26 g/mol
LogP1.73
Rot. Bonds2

About N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine

N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine (PubChem CID 164656950) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine.

Molecular Properties

Compound NameN-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine
PubChem CID164656950
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC NameN-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine
SMILESCC1OCCC1Nc1cnsc1
InChIInChI=1S/C8H12N2OS/c1-6-8(2-3-11-6)10-7-4-9-12-5-7/h4-6,8,10H,2-3H2,1H3
InChIKeyZKMKFPPWWCKRPB-UHFFFAOYSA-N
XLogP1.73
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-thiophen-3-yloxolan-3-amine
CID 82719132
(2R,3R)-N-(4-chlorophenyl)-2-methyloxolan-3-amine
CID 97358491
2-chloro-N-[(2R,3R)-2-methyloxolan-3-yl]pyridin-4-amine
CID 130671043
5-methyl-N-(2-methyloxolan-3-yl)pyridin-2-amine
CID 82728713
4-[(2-methyloxolan-3-yl)amino]benzonitrile
CID 82726591
N-[4-[(2-methyloxolan-3-yl)amino]phenyl]acetamide
CID 82716841
(2R,3R)-N-(3,4-difluorophenyl)-2-methyloxolan-3-amine
CID 97358475
N-(3-fluoro-5-methylphenyl)-2-methyloxolan-3-amine
CID 75525403
(2R,3S)-N-(3-fluoro-5-methylphenyl)-2-methyloxolan-3-amine
CID 97358660
2,6-dichloro-4-[(2-methyloxolan-3-yl)amino]phenol
CID 107679147
4-N,6-N-bis(2-methyloxolan-3-yl)pyrimidine-4,6-diamine
CID 86797851
(2R,3S)-N-(3-fluorophenyl)-2-methyloxolan-3-amine
CID 97358489

Frequently Asked Questions

What is the IUPAC name of N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine?
The IUPAC name of N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine (CID 164656950) is N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine.
What is the SMILES notation for N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine?
The canonical SMILES for N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine is CC1OCCC1Nc1cnsc1.
What is the InChIKey of N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine?
The InChIKey is ZKMKFPPWWCKRPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-6-8(2-3-11-6)10-7-4-9-12-5-7/h4-6,8,10H,2-3H2,1H3.
What are the key properties of N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine?
N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine has a molecular weight of 184.26 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyloxolan-3-yl)-1,2-thiazol-4-amine is sourced from PubChem (CID 164656950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).