1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine

C14H20N4S — CID 106566109

IUPAC1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine
SMILESCc1nc(CNc2nccn2C2CCCCC2)cs1
InChIInChI=1S/C14H20N4S/c1-11-17-12(10-19-11)9-16-14-15-7-8-18(14)13-5-3-2-4-6-13/h7-8,10,13H,2-6,9H2,1H3,(H,15,16)
InChIKeyCNROKQUTWHDFBX-UHFFFAOYSA-N
MW276.41 g/mol
LogP3.77
Rot. Bonds4

About 1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine

1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine (PubChem CID 106566109) has the molecular formula C14H20N4S and a molecular weight of 276.41 g/mol. Its IUPAC name is 1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine
PubChem CID106566109
Molecular FormulaC14H20N4S
Molecular Weight276.41 g/mol
Exact Mass276.14
IUPAC Name1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine
SMILESCc1nc(CNc2nccn2C2CCCCC2)cs1
InChIInChI=1S/C14H20N4S/c1-11-17-12(10-19-11)9-16-14-15-7-8-18(14)13-5-3-2-4-6-13/h7-8,10,13H,2-6,9H2,1H3,(H,15,16)
InChIKeyCNROKQUTWHDFBX-UHFFFAOYSA-N
XLogP3.77
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclohexyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazol-2-amine
CID 106566290
1-cyclohexyl-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine
CID 106569352
1-cyclohexyl-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine
CID 106579096
1-cyclopentyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
CID 106571823
1-cyclopentyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine
CID 106567817
N-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexanamine
CID 28780749
1-cyclopentyl-N-(thiophen-2-ylmethyl)imidazol-2-amine
CID 106561409
1-cyclohexyl-N-[(2-ethylphenyl)methyl]imidazol-2-amine
CID 106574558
1-cyclohexyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
CID 106574874
1-cyclohexyl-N-[(4-fluorophenyl)methyl]imidazol-2-amine
CID 106558880
1-cyclohexyl-N-(2-cyclopropylethyl)imidazol-2-amine
CID 106575828
1-cyclopentyl-N-(2,3-dimethylbutyl)imidazol-2-amine
CID 106575250

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine?
The IUPAC name of 1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine (CID 106566109) is 1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine.
What is the SMILES notation for 1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine?
The canonical SMILES for 1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine is Cc1nc(CNc2nccn2C2CCCCC2)cs1.
What is the InChIKey of 1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine?
The InChIKey is CNROKQUTWHDFBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4S/c1-11-17-12(10-19-11)9-16-14-15-7-8-18(14)13-5-3-2-4-6-13/h7-8,10,13H,2-6,9H2,1H3,(H,15,16).
What are the key properties of 1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine?
1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine has a molecular weight of 276.41 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine is sourced from PubChem (CID 106566109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).