2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine

C14H24N2S — CID 65412814

IUPAC2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine
SMILESCC1CCC(c2ncc(CNC(C)(C)C)s2)C1
InChIInChI=1S/C14H24N2S/c1-10-5-6-11(7-10)13-15-8-12(17-13)9-16-14(2,3)4/h8,10-11,16H,5-7,9H2,1-4H3
InChIKeyUEZWBGNLLMGPRO-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.93
Rot. Bonds3

About 2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine

2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine (PubChem CID 65412814) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine
PubChem CID65412814
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine
SMILESCC1CCC(c2ncc(CNC(C)(C)C)s2)C1
InChIInChI=1S/C14H24N2S/c1-10-5-6-11(7-10)13-15-8-12(17-13)9-16-14(2,3)4/h8,10-11,16H,5-7,9H2,1-4H3
InChIKeyUEZWBGNLLMGPRO-UHFFFAOYSA-N
XLogP3.93
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 ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine (CID 65412814) is 2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine is CC1CCC(c2ncc(CNC(C)(C)C)s2)C1.
What is the InChIKey of 2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine?
The InChIKey is UEZWBGNLLMGPRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-10-5-6-11(7-10)13-15-8-12(17-13)9-16-14(2,3)4/h8,10-11,16H,5-7,9H2,1-4H3.
What are the key properties of 2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine?
2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine has a molecular weight of 252.43 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-(3-methylcyclopentyl)-1,3-thiazol-5-yl]methyl]propan-2-amine is sourced from PubChem (CID 65412814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).