1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine

C13H20N2S — CID 116887445

IUPAC1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine
SMILESCc1nc(C2CCCCC2)sc1C1(N)CC1
InChIInChI=1S/C13H20N2S/c1-9-11(13(14)7-8-13)16-12(15-9)10-5-3-2-4-6-10/h10H,2-8,14H2,1H3
InChIKeySAOXUUOWABBBRU-UHFFFAOYSA-N
MW236.38 g/mol
LogP3.45
Rot. Bonds2

About 1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine

1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine (PubChem CID 116887445) has the molecular formula C13H20N2S and a molecular weight of 236.38 g/mol. Its IUPAC name is 1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine
PubChem CID116887445
Molecular FormulaC13H20N2S
Molecular Weight236.38 g/mol
Exact Mass236.13
IUPAC Name1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine
SMILESCc1nc(C2CCCCC2)sc1C1(N)CC1
InChIInChI=1S/C13H20N2S/c1-9-11(13(14)7-8-13)16-12(15-9)10-5-3-2-4-6-10/h10H,2-8,14H2,1H3
InChIKeySAOXUUOWABBBRU-UHFFFAOYSA-N
XLogP3.45
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.38
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-cyclobutyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine
CID 116887451
[1-(2-cyclobutyl-4-methyl-1,3-thiazol-5-yl)cyclopropyl]methanamine
CID 116886917
(2-cycloheptyl-4-methyl-1,3-thiazol-5-yl)methanamine
CID 65400000
[1-(2-cyclobutyl-4-methyl-1,3-thiazol-5-yl)cyclopropyl]methanol
CID 116886884
[3-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)oxetan-3-yl]methanol
CID 116887101
2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole
CID 116885152
4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine
CID 116885301
1-[2-(4,4-dimethylcyclohexyl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 65390265
1-[2-(4-bromophenyl)-4-methyl-1,3-thiazol-5-yl]cyclopropan-1-amine
CID 116887417
1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)propan-2-one
CID 116886443
2-amino-1-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)ethanol
CID 116886750
N-[(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methyl]ethanamine
CID 62403369

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine?
The IUPAC name of 1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine (CID 116887445) is 1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine.
What is the SMILES notation for 1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine?
The canonical SMILES for 1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine is Cc1nc(C2CCCCC2)sc1C1(N)CC1.
What is the InChIKey of 1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine?
The InChIKey is SAOXUUOWABBBRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2S/c1-9-11(13(14)7-8-13)16-12(15-9)10-5-3-2-4-6-10/h10H,2-8,14H2,1H3.
What are the key properties of 1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine?
1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine has a molecular weight of 236.38 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine is sourced from PubChem (CID 116887445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).