4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide

C15H26N4OS — CID 116668367

IUPAC4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide
SMILESCCN(CC)c1nc(N)c(C(=O)N(C)C2CCCCC2)s1
InChIInChI=1S/C15H26N4OS/c1-4-19(5-2)15-17-13(16)12(21-15)14(20)18(3)11-9-7-6-8-10-11/h11H,4-10,16H2,1-3H3
InChIKeyVBWRWPBSBKXLRA-UHFFFAOYSA-N
MW310.47 g/mol
LogP2.98
Rot. Bonds5

About 4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide

4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide (PubChem CID 116668367) has the molecular formula C15H26N4OS and a molecular weight of 310.47 g/mol. Its IUPAC name is 4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide
PubChem CID116668367
Molecular FormulaC15H26N4OS
Molecular Weight310.47 g/mol
Exact Mass310.18
IUPAC Name4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide
SMILESCCN(CC)c1nc(N)c(C(=O)N(C)C2CCCCC2)s1
InChIInChI=1S/C15H26N4OS/c1-4-19(5-2)15-17-13(16)12(21-15)14(20)18(3)11-9-7-6-8-10-11/h11H,4-10,16H2,1-3H3
InChIKeyVBWRWPBSBKXLRA-UHFFFAOYSA-N
XLogP2.98
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.47
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-cyclohexyl-N-ethyl-2-[ethyl(methyl)amino]-1,3-thiazole-5-carboxamide
CID 116668423
4-amino-N-cyclopentyl-N-methyl-2-piperidin-1-yl-1,3-thiazole-5-carboxamide
CID 116669506
4-amino-2-[ethyl(methyl)amino]-N-(2-hydroxycyclohexyl)-N-methyl-1,3-thiazole-5-carboxamide
CID 102640262
4-amino-2-(diethylamino)-N-methyl-N-(oxolan-2-ylmethyl)-1,3-thiazole-5-carboxamide
CID 116663311
4-amino-2-(dimethylamino)-N-methyl-N-(oxan-4-yl)-1,3-thiazole-5-carboxamide
CID 116670500
4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide
CID 116664324
4-amino-2-(diethylamino)-N-methyl-N-[2-(methylamino)ethyl]-1,3-thiazole-5-carboxamide
CID 116666701
4-amino-2-(diethylamino)-N-methyl-N-prop-2-enyl-1,3-thiazole-5-carboxamide
CID 116672061
4-amino-2-(diethylamino)-N-(2-methoxyethyl)-N-methyl-1,3-thiazole-5-carboxamide
CID 116663278
4-amino-2-(diethylamino)-N-[2-(ethylamino)-2-oxoethyl]-N-methyl-1,3-thiazole-5-carboxamide
CID 116664138
4-amino-2-(tert-butylamino)-N-cyclopentyl-N-methyl-1,3-thiazole-5-carboxamide
CID 116669495
4-amino-2-(diethylamino)-N-(thiolan-2-ylmethyl)-1,3-thiazole-5-carboxamide
CID 116671370

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide (CID 116668367) is 4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide is CCN(CC)c1nc(N)c(C(=O)N(C)C2CCCCC2)s1.
What is the InChIKey of 4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is VBWRWPBSBKXLRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4OS/c1-4-19(5-2)15-17-13(16)12(21-15)14(20)18(3)11-9-7-6-8-10-11/h11H,4-10,16H2,1-3H3.
What are the key properties of 4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide?
4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 310.47 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 116668367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).