1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide

C12H18N4O2S — CID 62793582

IUPAC1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(C(=O)c2sc(N)nc2C)CC1
InChIInChI=1S/C12H18N4O2S/c1-7-9(19-12(13)15-7)11(18)16-5-3-8(4-6-16)10(17)14-2/h8H,3-6H2,1-2H3,(H2,13,15)(H,14,17)
InChIKeyRHTFVICPNMGLQH-UHFFFAOYSA-N
MW282.37 g/mol
LogP0.63
Rot. Bonds2

About 1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide

1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide (PubChem CID 62793582) has the molecular formula C12H18N4O2S and a molecular weight of 282.37 g/mol. Its IUPAC name is 1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide
PubChem CID62793582
Molecular FormulaC12H18N4O2S
Molecular Weight282.37 g/mol
Exact Mass282.12
IUPAC Name1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(C(=O)c2sc(N)nc2C)CC1
InChIInChI=1S/C12H18N4O2S/c1-7-9(19-12(13)15-7)11(18)16-5-3-8(4-6-16)10(17)14-2/h8H,3-6H2,1-2H3,(H2,13,15)(H,14,17)
InChIKeyRHTFVICPNMGLQH-UHFFFAOYSA-N
XLogP0.63
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2-amino-4-methyl-1,3-thiazol-5-yl)-[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 104872448
(2-amino-4-methyl-1,3-thiazol-5-yl)-[4-[(dimethylamino)methyl]piperidin-1-yl]methanone
CID 62793622
1-[4-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)piperazin-1-yl]ethanone
CID 62792562
(2-amino-4-methyl-1,3-thiazol-5-yl)-[(3S)-3-hydroxypyrrolidin-1-yl]methanone
CID 94896080
(2-amino-4-methyl-1,3-thiazol-5-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone
CID 63979394
(2-amino-4-methyl-1,3-thiazol-5-yl)-[3-(dimethylamino)pyrrolidin-1-yl]methanone
CID 63167266
(2-amino-4-methyl-1,3-thiazol-5-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
CID 114678315
(2-amino-4-methyl-1,3-thiazol-5-yl)-(4-tert-butylpiperazin-1-yl)methanone
CID 62793634
4-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N,N-dimethylpiperazine-1-carboxamide
CID 62792932
4-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-ethylpiperazine-1-carboxamide
CID 62793779
4-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylmorpholine-3-carboxamide
CID 83097443
methyl 1-(2-amino-4-ethyl-1,3-thiazole-5-carbonyl)piperidine-4-carboxylate
CID 171703961

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide (CID 62793582) is 1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide is CNC(=O)C1CCN(C(=O)c2sc(N)nc2C)CC1.
What is the InChIKey of 1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide?
The InChIKey is RHTFVICPNMGLQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2S/c1-7-9(19-12(13)15-7)11(18)16-5-3-8(4-6-16)10(17)14-2/h8H,3-6H2,1-2H3,(H2,13,15)(H,14,17).
What are the key properties of 1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide?
1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide has a molecular weight of 282.37 g/mol, XLogP of 0.63, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 62793582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).