4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide

C14H24N4O2S — CID 116664324

IUPAC4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide
SMILESCN(C)c1nc(N)c(C(=O)N(CCO)C2CCCCC2)s1
InChIInChI=1S/C14H24N4O2S/c1-17(2)14-16-12(15)11(21-14)13(20)18(8-9-19)10-6-4-3-5-7-10/h10,19H,3-9,15H2,1-2H3
InChIKeyWFOUHGBIWDUUFZ-UHFFFAOYSA-N
MW312.44 g/mol
LogP1.56
Rot. Bonds5

About 4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide

4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide (PubChem CID 116664324) has the molecular formula C14H24N4O2S and a molecular weight of 312.44 g/mol. Its IUPAC name is 4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide
PubChem CID116664324
Molecular FormulaC14H24N4O2S
Molecular Weight312.44 g/mol
Exact Mass312.16
IUPAC Name4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide
SMILESCN(C)c1nc(N)c(C(=O)N(CCO)C2CCCCC2)s1
InChIInChI=1S/C14H24N4O2S/c1-17(2)14-16-12(15)11(21-14)13(20)18(8-9-19)10-6-4-3-5-7-10/h10,19H,3-9,15H2,1-2H3
InChIKeyWFOUHGBIWDUUFZ-UHFFFAOYSA-N
XLogP1.56
TPSA82.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-2-(dimethylamino)-N,N-bis(2-hydroxyethyl)-1,3-thiazole-5-carboxamide
CID 116670876
4-amino-N-cyclohexyl-N-ethyl-2-[ethyl(methyl)amino]-1,3-thiazole-5-carboxamide
CID 116668423
4-amino-N-cyclopropyl-N-(2-hydroxyethyl)-2-(methylamino)-1,3-thiazole-5-carboxamide
CID 116664274
4-amino-N-cyclohexyl-2-(diethylamino)-N-methyl-1,3-thiazole-5-carboxamide
CID 116668367
4-amino-N,N-bis(cyclopropylmethyl)-2-(dimethylamino)-1,3-thiazole-5-carboxamide
CID 116666777
4-amino-N-cyclopropyl-2-(dimethylamino)-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide
CID 116663483
4-amino-2-(dimethylamino)-N-methyl-N-(oxan-4-yl)-1,3-thiazole-5-carboxamide
CID 116670500
4-amino-N-(cyclopropylmethyl)-2-(dimethylamino)-N-propyl-1,3-thiazole-5-carboxamide
CID 116663408
[4-amino-2-(dimethylamino)-1,3-thiazol-5-yl]-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 107229398
4-amino-N-(2-cyclopropylethyl)-2-(dimethylamino)-1,3-thiazole-5-carboxamide
CID 116667320
4-amino-2-(dimethylamino)-N-methyl-N-pent-4-enyl-1,3-thiazole-5-carboxamide
CID 116673980
4-amino-2-(dimethylamino)-N-methyl-N-prop-2-ynyl-1,3-thiazole-5-carboxamide
CID 116671884

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide (CID 116664324) is 4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide is CN(C)c1nc(N)c(C(=O)N(CCO)C2CCCCC2)s1.
What is the InChIKey of 4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide?
The InChIKey is WFOUHGBIWDUUFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2S/c1-17(2)14-16-12(15)11(21-14)13(20)18(8-9-19)10-6-4-3-5-7-10/h10,19H,3-9,15H2,1-2H3.
What are the key properties of 4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide?
4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide has a molecular weight of 312.44 g/mol, XLogP of 1.56, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclohexyl-2-(dimethylamino)-N-(2-hydroxyethyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 116664324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).