4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide

C14H24N4OS — CID 116666232

IUPAC4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide
SMILESCCN(C)c1nc(N)c(C(=O)N(C)CC2CCCC2)s1
InChIInChI=1S/C14H24N4OS/c1-4-17(2)14-16-12(15)11(20-14)13(19)18(3)9-10-7-5-6-8-10/h10H,4-9,15H2,1-3H3
InChIKeyLRTDHYDMTIUECL-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.44
Rot. Bonds5

About 4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide

4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide (PubChem CID 116666232) has the molecular formula C14H24N4OS and a molecular weight of 296.44 g/mol. Its IUPAC name is 4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide
PubChem CID116666232
Molecular FormulaC14H24N4OS
Molecular Weight296.44 g/mol
Exact Mass296.17
IUPAC Name4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide
SMILESCCN(C)c1nc(N)c(C(=O)N(C)CC2CCCC2)s1
InChIInChI=1S/C14H24N4OS/c1-4-17(2)14-16-12(15)11(20-14)13(19)18(3)9-10-7-5-6-8-10/h10H,4-9,15H2,1-3H3
InChIKeyLRTDHYDMTIUECL-UHFFFAOYSA-N
XLogP2.44
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-2-[ethyl(methyl)amino]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-1,3-thiazole-5-carboxamide
CID 116671275
4-amino-N-cyclohexyl-N-ethyl-2-[ethyl(methyl)amino]-1,3-thiazole-5-carboxamide
CID 116668423
4-amino-2-[ethyl(methyl)amino]-N-(2-hydroxycyclohexyl)-N-methyl-1,3-thiazole-5-carboxamide
CID 102640262
4-amino-N-(cyclobutylmethyl)-2-(ethylamino)-N-methyl-1,3-thiazole-5-carboxamide
CID 116665637
4-amino-2-[ethyl(methyl)amino]-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1,3-thiazole-5-carboxamide
CID 116664409
4-amino-N-butan-2-yl-N-ethyl-2-[ethyl(methyl)amino]-1,3-thiazole-5-carboxamide
CID 116669640
[4-amino-2-[ethyl(methyl)amino]-1,3-thiazol-5-yl]-(4-ethylazepan-1-yl)methanone
CID 116666847
[4-amino-2-[ethyl(methyl)amino]-1,3-thiazol-5-yl]-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 107229399
[4-amino-2-[ethyl(methyl)amino]-1,3-thiazol-5-yl]-(2,6-dimethylpiperidin-1-yl)methanone
CID 116668941
[4-amino-2-[ethyl(methyl)amino]-1,3-thiazol-5-yl]-(3,4-dihydroxypyrrolidin-1-yl)methanone
CID 106674692
4-amino-2-(diethylamino)-N-methyl-N-(oxolan-2-ylmethyl)-1,3-thiazole-5-carboxamide
CID 116663311
4-amino-2-[ethyl(methyl)amino]-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]-1,3-thiazole-5-carboxamide
CID 106918874

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide (CID 116666232) is 4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide is CCN(C)c1nc(N)c(C(=O)N(C)CC2CCCC2)s1.
What is the InChIKey of 4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is LRTDHYDMTIUECL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4OS/c1-4-17(2)14-16-12(15)11(20-14)13(19)18(3)9-10-7-5-6-8-10/h10H,4-9,15H2,1-3H3.
What are the key properties of 4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide?
4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 296.44 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(cyclopentylmethyl)-2-[ethyl(methyl)amino]-N-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 116666232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).