2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine

C14H24N2S — CID 61333826

IUPAC2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine
SMILESCc1csc(C2(NC(C)C)CCCCC2C)n1
InChIInChI=1S/C14H24N2S/c1-10(2)16-14(8-6-5-7-11(14)3)13-15-12(4)9-17-13/h9-11,16H,5-8H2,1-4H3
InChIKeyACLUTZBFQDOPQD-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.85
Rot. Bonds3

About 2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine

2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine (PubChem CID 61333826) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine.

Molecular Properties

Compound Name2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine
PubChem CID61333826
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine
SMILESCc1csc(C2(NC(C)C)CCCCC2C)n1
InChIInChI=1S/C14H24N2S/c1-10(2)16-14(8-6-5-7-11(14)3)13-15-12(4)9-17-13/h9-11,16H,5-8H2,1-4H3
InChIKeyACLUTZBFQDOPQD-UHFFFAOYSA-N
XLogP3.85
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine?
The IUPAC name of 2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine (CID 61333826) is 2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine.
What is the SMILES notation for 2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine?
The canonical SMILES for 2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine is Cc1csc(C2(NC(C)C)CCCCC2C)n1.
What is the InChIKey of 2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine?
The InChIKey is ACLUTZBFQDOPQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-10(2)16-14(8-6-5-7-11(14)3)13-15-12(4)9-17-13/h9-11,16H,5-8H2,1-4H3.
What are the key properties of 2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine?
2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine has a molecular weight of 252.43 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclohexan-1-amine is sourced from PubChem (CID 61333826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).