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

C11H17N3OS — CID 104872552

IUPAC2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide
SMILESCCCC1CC1NC(=O)c1sc(N)nc1C
InChIInChI=1S/C11H17N3OS/c1-3-4-7-5-8(7)14-10(15)9-6(2)13-11(12)16-9/h7-8H,3-5H2,1-2H3,(H2,12,13)(H,14,15)
InChIKeyGQCGESQPPVUHCM-UHFFFAOYSA-N
MW239.34 g/mol
LogP1.95
Rot. Bonds4

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

2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide (PubChem CID 104872552) has the molecular formula C11H17N3OS and a molecular weight of 239.34 g/mol. Its IUPAC name is 2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide
PubChem CID104872552
Molecular FormulaC11H17N3OS
Molecular Weight239.34 g/mol
Exact Mass239.11
IUPAC Name2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide
SMILESCCCC1CC1NC(=O)c1sc(N)nc1C
InChIInChI=1S/C11H17N3OS/c1-3-4-7-5-8(7)14-10(15)9-6(2)13-11(12)16-9/h7-8H,3-5H2,1-2H3,(H2,12,13)(H,14,15)
InChIKeyGQCGESQPPVUHCM-UHFFFAOYSA-N
XLogP1.95
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide
CID 45058673
2-amino-N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 62793752
2-amino-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]-1,3-thiazole-5-carboxamide
CID 62792561
2-amino-4-methyl-N-(5-oxopyrrolidin-3-yl)-1,3-thiazole-5-carboxamide
CID 106187689
2-amino-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 118773357
(3S,4S)-1-(2-amino-4-methyl-1,3-thiazole-5-carbonyl)-4-propylpyrrolidine-3-carboxylic acid
CID 72860789
2-amino-4-methyl-N-(oxolan-3-yl)-1,3-thiazole-5-carboxamide
CID 80713116
2-amino-N-(dicyclopropylmethyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 62792433
2-amino-4-methyl-N-[(2-methylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide
CID 55115770
N-[2-(aminomethyl)cyclohexyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119610117
N-(2-propylcyclopropyl)-1,3-thiazole-4-carboxamide
CID 103713530
2-amino-N-(2-ethyl-2-hydroxybutyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 65106677

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide (CID 104872552) is 2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide is CCCC1CC1NC(=O)c1sc(N)nc1C.
What is the InChIKey of 2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide?
The InChIKey is GQCGESQPPVUHCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3OS/c1-3-4-7-5-8(7)14-10(15)9-6(2)13-11(12)16-9/h7-8H,3-5H2,1-2H3,(H2,12,13)(H,14,15).
What are the key properties of 2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide?
2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide has a molecular weight of 239.34 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-N-(2-propylcyclopropyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 104872552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).