4-methyl-5-propan-2-yl-1,3-thiazol-2-amine

C7H12N2S — CID 10397060

IUPAC4-methyl-5-propan-2-yl-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1C(C)C
InChIInChI=1S/C7H12N2S/c1-4(2)6-5(3)9-7(8)10-6/h4H,1-3H3,(H2,8,9)
InChIKeyLRKDQFQWYDHSCY-UHFFFAOYSA-N
MW156.25 g/mol
LogP2.16
Rot. Bonds1

About 4-methyl-5-propan-2-yl-1,3-thiazol-2-amine

4-methyl-5-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 10397060) has the molecular formula C7H12N2S and a molecular weight of 156.25 g/mol. Its IUPAC name is 4-methyl-5-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-5-propan-2-yl-1,3-thiazol-2-amine
PubChem CID10397060
Molecular FormulaC7H12N2S
Molecular Weight156.25 g/mol
Exact Mass156.07
IUPAC Name4-methyl-5-propan-2-yl-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1C(C)C
InChIInChI=1S/C7H12N2S/c1-4(2)6-5(3)9-7(8)10-6/h4H,1-3H3,(H2,8,9)
InChIKeyLRKDQFQWYDHSCY-UHFFFAOYSA-N
XLogP2.16
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.25
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-propan-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-5-propan-2-yl-1,3-thiazol-2-amine (CID 10397060) is 4-methyl-5-propan-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-5-propan-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-5-propan-2-yl-1,3-thiazol-2-amine is Cc1nc(N)sc1C(C)C.
What is the InChIKey of 4-methyl-5-propan-2-yl-1,3-thiazol-2-amine?
The InChIKey is LRKDQFQWYDHSCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2S/c1-4(2)6-5(3)9-7(8)10-6/h4H,1-3H3,(H2,8,9).
What are the key properties of 4-methyl-5-propan-2-yl-1,3-thiazol-2-amine?
4-methyl-5-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 156.25 g/mol, XLogP of 2.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 10397060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).