N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine

C14H24N2S — CID 61330024

IUPACN,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine
SMILESCCNC1(c2nc(C)cs2)CCC(CC)CC1
InChIInChI=1S/C14H24N2S/c1-4-12-6-8-14(9-7-12,15-5-2)13-16-11(3)10-17-13/h10,12,15H,4-9H2,1-3H3
InChIKeyFQXUAQFLLUARHO-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.86
Rot. Bonds4

About N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine

N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine (PubChem CID 61330024) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine.

Molecular Properties

Compound NameN,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine
PubChem CID61330024
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC NameN,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine
SMILESCCNC1(c2nc(C)cs2)CCC(CC)CC1
InChIInChI=1S/C14H24N2S/c1-4-12-6-8-14(9-7-12,15-5-2)13-16-11(3)10-17-13/h10,12,15H,4-9H2,1-3H3
InChIKeyFQXUAQFLLUARHO-UHFFFAOYSA-N
XLogP3.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine?
The IUPAC name of N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine (CID 61330024) is N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine.
What is the SMILES notation for N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine?
The canonical SMILES for N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine is CCNC1(c2nc(C)cs2)CCC(CC)CC1.
What is the InChIKey of N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine?
The InChIKey is FQXUAQFLLUARHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-4-12-6-8-14(9-7-12,15-5-2)13-16-11(3)10-17-13/h10,12,15H,4-9H2,1-3H3.
What are the key properties of N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine?
N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine has a molecular weight of 252.43 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-diethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine is sourced from PubChem (CID 61330024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).