4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine

C10H16N2OS — CID 115028003

IUPAC4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine
SMILESCC(C)c1sc(N)nc1C1CCCO1
InChIInChI=1S/C10H16N2OS/c1-6(2)9-8(12-10(11)14-9)7-4-3-5-13-7/h6-7H,3-5H2,1-2H3,(H2,11,12)
InChIKeyPCEDBACMNPZDQW-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.70
Rot. Bonds2

About 4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine

4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 115028003) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine
PubChem CID115028003
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine
SMILESCC(C)c1sc(N)nc1C1CCCO1
InChIInChI=1S/C10H16N2OS/c1-6(2)9-8(12-10(11)14-9)7-4-3-5-13-7/h6-7H,3-5H2,1-2H3,(H2,11,12)
InChIKeyPCEDBACMNPZDQW-UHFFFAOYSA-N
XLogP2.70
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-5-(oxolan-2-yl)-4-propan-2-yl-1H-imidazole
CID 115028945
4-[(2R)-oxolan-2-yl]-1,3-thiazol-2-amine
CID 86336609
[2-(oxolan-2-yl)-4-propan-2-yl-1,3-thiazol-5-yl]methanethiol
CID 82434676
3-[3-(oxolan-2-yl)-1,2,4-oxadiazol-5-yl]butan-2-amine;hydrochloride
CID 120893845
(1R)-2-methyl-1-[5-[(2S)-oxolan-2-yl]-1H-1,2,4-triazol-3-yl]propan-1-amine
CID 97288537
4-[4-cyclopropyl-2-(oxolan-2-yl)-1,3-thiazol-5-yl]-1,3-thiazol-2-amine
CID 82437022
6-[(2S)-oxolan-2-yl]-3-propan-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
CID 95559024
2-[5-methyl-4-(oxolan-2-yl)-1,3-thiazol-2-yl]acetic acid
CID 115036116
3-methyl-1-[3-(oxolan-2-yl)-1,2,4-oxadiazol-5-yl]butan-2-amine
CID 65330095
3-[5-methyl-4-(oxolan-2-yl)-1,3-thiazol-2-yl]propan-1-ol
CID 115036296
5-bromo-2-chloro-6-[(2R)-oxolan-2-yl]-4-[(2S)-oxolan-2-yl]pyrimidine
CID 134854426
2-methyl-5-(oxolan-2-yl)-1,3,4-thiadiazole
CID 58853375

Frequently Asked Questions

What is the IUPAC name of 4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine (CID 115028003) is 4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine is CC(C)c1sc(N)nc1C1CCCO1.
What is the InChIKey of 4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine?
The InChIKey is PCEDBACMNPZDQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-6(2)9-8(12-10(11)14-9)7-4-3-5-13-7/h6-7H,3-5H2,1-2H3,(H2,11,12).
What are the key properties of 4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine?
4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 212.32 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxolan-2-yl)-5-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 115028003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).